79-27-6 structure, C2H2Br4

1,1,2,2-Tetrabromoethane

CAS No.

79-27-6

Formula:

C2H2Br4

Basic Info

Tetrabromoethane (TBE) is a halogenated hydrocarbon, chemical formula C2H2Br4. Although three bromine atoms may bind to one of the carbon atoms creating 1,1,1,2-tetrabromoethane this is not thermodynamically favorable, so in practice tetrabromoethane is equal to 1,1,2,2-tetrabromoethane, where each carbon atom binds two bromine atoms.
It has an unusually high density for an organic compound, near 3 g/mL, due largely to the four bromine atoms. TBE is a liquid at room temperature, and is used to separate mineral ores from its supporting rock by means of preferential flotation. Sand, limestone, dolomite, and other types of rock material will float on TBE, while minerals such as sphalerite, galena and pyrite will sink. A related compound, bromoform, is also sometimes used in these applications, however, TBE is more practical because of its wider liquid range and lower vapor pressure. Acute TBE poisoning has been known to occur.

Formula
C2H2Br4
Molecular Weight
345.653
Exact Mass
341.689
LogP
3.2182
PSA
0
Synonyms

Muthmanns liquid

sym-Tetrabromoethane

Ethane,1,1,2,2-tetrabromo

Acetylene tetrabromide

Ethane, 1,1,2,2-tetrabromo-

tetrabromo-1,1,2,2 ethane

1,1,2,2,-tetrabromoethane

s-Tetrabromoethane

Tetrabromoacetylene

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Properties

Appearance & Physical State
Colorless to yellowish liquid.
Density
2.966
Boiling Point
244ºC
Melting Point
-2ºC
Flash Point
97ºC
Refractive Index
1.636-1.638
Water Solubility
0.63 g/L (20 ºC)
Stability
Stable. Incompatible with strong oxidizing agents, aluminium, magnesium, alkali metals.
Storage Condition
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep away from metals.
Vapor Density
11.9 (vs air)
Vapor Pressure
0.1 mm Hg ( 20 °C)

Safety Info

RTECS
KI8225000
Safety Statements
S1/2-S24-S27-S45-S61
WGK Germany
2
Risk Statements
R26; R36; R52/53
HS Code
29033036
RIDADR
UN 2504
Hazard Class
6.1
Packing Group
III
Hazard Codes

MSDS

SDS 1.0
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SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,1,2,2-Tetrabromoethane

1.2 Other means of identification

Product number -
Other names Muthmanns liquid

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

Company MOLBASE (Shanghai) Biotechnology Co., Ltd.
Address Floor 4 & 5, Building 12, No. 1001 North Qinzhou Road,
Xuhui District, Shanghai, China
Telephone +86(21)64956998
Fax +86(21)54365166

1.5 Emergency phone number

Emergency phone number +86-400-6021-666
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

2.Hazard identification

2.1 Classification of the substance or mixture

Eye irritation, Category 2

Acute toxicity - Inhalation, Category 2

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 3

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H319 Causes serious eye irritation

H330 Fatal if inhaled

H412 Harmful to aquatic life with long lasting effects

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P271 Use only outdoors or in a well-ventilated area.

P284 [In case of inadequate ventilation] wear respiratory protection.

P273 Avoid release to the environment.

Response

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P337+P313 If eye irritation persists: Get medical advice/attention.

P304+P340 IF INHALED: Remove person to fresh air and keep comfortable for breathing.

P310 Immediately call a POISON CENTER/doctor/…

P320 Specific treatment is urgent (see ... on this label).

Storage

P403+P233 Store in a well-ventilated place. Keep container tightly closed.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

3.Composition/information on ingredients

3.1 Substances

Chemical name Common names and synonyms CAS number EC number Concentration
1,1,2,2-Tetrabromoethane 1,1,2,2-Tetrabromoethane 79-27-6 none 100%

4.First-aid measures

4.1 Description of necessary first-aid measures

General advice

Consult a physician. Show this safety data sheet to the doctor in attendance.

If inhaled

Fresh air, rest. Refer for medical attention.

In case of skin contact

Remove contaminated clothes. Rinse and then wash skin with water and soap.

In case of eye contact

First rinse with plenty of water for several minutes (remove contact lenses if easily possible), then refer for medical attention.

If swallowed

Rinse mouth. Refer for medical attention .

4.2 Most important symptoms/effects, acute and delayed

Excerpt from ERG Guide 159 [Substances (Irritating)]: Inhalation of vapors or dust is extremely irritating. May cause burning of eyes and flow of tears. May cause coughing, difficult breathing and nausea. Brief exposure effects last only a few minutes. Exposure in an enclosed area may be very harmful. Fire will produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may cause pollution. (ERG, 2016)

4.3 Indication of immediate medical attention and special treatment needed, if necessary

Basic treatment: Establish a patent airway. Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with normal saline during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 ml/kg up to 200 ml of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool. Administer activated charcoal ... . /Aliphatic hydrocarbons and related compounds/

5.Fire-fighting measures

5.1 Extinguishing media

Suitable extinguishing media

To fight a fire /involving/ acetylene tetrabromide use dry chemical, carbon dioxide, water-foam, or fog.

5.2 Specific hazards arising from the chemical

Excerpt from ERG Guide 159 [Substances (Irritating)]: Some of these materials may burn, but none ignite readily. Containers may explode when heated. (ERG, 2016)

5.3 Special protective actions for fire-fighters

Wear self-contained breathing apparatus for firefighting if necessary.

6.Accidental release measures

6.1 Personal precautions, protective equipment and emergency procedures

Use personal protective equipment. Avoid dust formation. Avoid breathing vapours, mist or gas. Ensure adequate ventilation. Evacuate personnel to safe areas. Avoid breathing dust. For personal protection see section 8.

6.2 Environmental precautions

Collect leaking and spilled liquid in sealable containers as far as possible. Absorb remaining liquid in dry sand or inert absorbent. Then store and dispose of according to local regulations. Do NOT let this chemical enter the environment. Personal protection: self-contained breathing apparatus.

6.3 Methods and materials for containment and cleaning up

1. VENTILATE AREA OF SPILL OR LEAK. 2. COLLECT FOR RECLAMATION OR ABSORB IN VERMICULITE, DRY SAND, EARTH, OR A SIMILAR MATERIAL.

7.Handling and storage

7.1 Precautions for safe handling

Avoid contact with skin and eyes. Avoid formation of dust and aerosols. Avoid exposure - obtain special instructions before use.Provide appropriate exhaust ventilation at places where dust is formed. For precautions see section 2.2.

7.2 Conditions for safe storage, including any incompatibilities

Separated from strong oxidants, strong bases and food and feedstuffs. Well closed. Ventilation along the floor.Store in a cool, dry, well-ventilated location. Separate from oxidizing materials and alkalies.

8.Exposure controls/personal protection

8.1 Control parameters

Occupational Exposure limit values

After reviewing available published literature, NIOSH provided comments to OSHA on August 1, 1988, regarding the "Proposed Rule on Air Contaminants" (29 CFR 1910, Docket No. H-020). In these comments, NIOSH questioned whether the PEL proposed for acetylene tetrabromide [TWA 1 ppm] was adequate to protect workers from recognized health hazards.

Biological limit values

no data available

8.2 Appropriate engineering controls

Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and at the end of workday.

8.3 Individual protection measures, such as personal protective equipment (PPE)

Eye/face protection

Safety glasses with side-shields conforming to EN166. Use equipment for eye protection tested and approved under appropriate government standards such as NIOSH (US) or EN 166(EU).

Skin protection

Wear impervious clothing. The type of protective equipment must be selected according to the concentration and amount of the dangerous substance at the specific workplace. Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique(without touching glove's outer surface) to avoid skin contact with this product. Dispose of contaminated gloves after use in accordance with applicable laws and good laboratory practices. Wash and dry hands. The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and the standard EN 374 derived from it.

Respiratory protection

Wear dust mask when handling large quantities.

Thermal hazards

no data available

9.Physical and chemical properties

Physical state Colorless to yellowish liquid.
Colour Yellowish, heavy liquid /SRP: technical grade/
Odour Odor of camphor and iodoform
Melting point/ freezing point 0°C(lit.)
Boiling point or initial boiling point and boiling range 243°C
Flammability Noncombustible LiquidCombustible. Gives off irritating or toxic fumes (or gases) in a fire.
Lower and upper explosion limit / flammability limit no data available
Flash point -10°C(lit.)
Auto-ignition temperature 335°C
Decomposition temperature no data available
pH no data available
Kinematic viscosity no data available
Solubility In water:0.63 g/L (20 ºC)
Partition coefficient n-octanol/water (log value) 2.8
Vapour pressure 0.1 mm Hg ( 20 °C)
Density and/or relative density 2.966
Relative vapour density 11.9 (vs air)
Particle characteristics no data available

10.Stability and reactivity

10.1 Reactivity

no data available

10.2 Chemical stability

Heat /contributes to instability/.

10.3 Possibility of hazardous reactions

Non combustible.ACETYLENE TETRABROMIDE is incompatible with strong bases and chemically active metals. Incompatible with hot iron, aluminum and zinc in the presence of steam. May react with magnesium. Softens or destroys most plastics and rubber .

10.4 Conditions to avoid

no data available

10.5 Incompatible materials

Tetrabromoethane is chemically incompatible with active metals, strong caustics, hot iron, aluminum, or zinc in the presence of steam.

10.6 Hazardous decomposition products

NONCOMBUSTIBLE BUT DECOMPOSES @ 374 DEG F (190 DEG C) TO LIBERATE FLAMMABLE & HIGHLY TOXIC VAPORS. /SRP: EG, HYDROGEN BROMIDE AND CARBON MONOXIDE/

11.Toxicological information

Acute toxicity

  • Oral: LD50 Rat oral 1200 mg/kg
  • Inhalation: LC50 Rat inhalation 549 mg/cu m/4 hr
  • Dermal: no data available

Skin corrosion/irritation

no data available

Serious eye damage/irritation

no data available

Respiratory or skin sensitization

no data available

Germ cell mutagenicity

no data available

Carcinogenicity

no data available

Reproductive toxicity

no data available

STOT-single exposure

no data available

STOT-repeated exposure

no data available

Aspiration hazard

no data available

12.Ecological information

12.1 Toxicity

  • Toxicity to fish: no data available
  • Toxicity to daphnia and other aquatic invertebrates: no data available
  • Toxicity to algae: no data available
  • Toxicity to microorganisms: no data available

12.2 Persistence and degradability

AEROBIC: 1,1,2,2-Tetrabromoethane, present at 100 mg/l, reached 29% of its theoretical BOD in 2 weeks using an activated sludge inoculum at 30 mg/l and the Japanese MITI test(1).

12.3 Bioaccumulative potential

BCF values of <8.2 and 0.5 to 7 were measured for 1,1,2,2-tetrabromoethane at compound concns of 1 ug/l and 10 ug/l, respectively(1). According to a classification scheme(2), these values BCF suggest that bioconcentration in aquatic organisms is low(SRC).

12.4 Mobility in soil

The Koc of 1,1,2,2-tetrabromoethane is estimated as 120(SRC), using a water solubility of 678 mg/l(1) and a regression-derived equation(2). According to a classification scheme(3), this estimated Koc value suggests that 1,1,2,2-tetrabromoethane is expected to have high mobility in soil(SRC).

12.5 Other adverse effects

no data available

13.Disposal considerations

13.1 Disposal methods

Product

The material can be disposed of by removal to a licensed chemical destruction plant or by controlled incineration with flue gas scrubbing. Do not contaminate water, foodstuffs, feed or seed by storage or disposal. Do not discharge to sewer systems.

Contaminated packaging

Containers can be triply rinsed (or equivalent) and offered for recycling or reconditioning. Alternatively, the packaging can be punctured to make it unusable for other purposes and then be disposed of in a sanitary landfill. Controlled incineration with flue gas scrubbing is possible for combustible packaging materials.

14.Transport information

14.1 UN Number

ADR/RID: UN2504 IMDG: UN2504 IATA: UN2504

14.2 UN Proper Shipping Name

ADR/RID: TETRABROMOETHANE
IMDG: TETRABROMOETHANE
IATA: TETRABROMOETHANE

14.3 Transport hazard class(es)

ADR/RID: 6.1 IMDG: 6.1 IATA: 6.1

14.4 Packing group, if applicable

ADR/RID: III IMDG: III IATA: III

14.5 Environmental hazards

ADR/RID: no IMDG: no IATA: no

14.6 Special precautions for user

no data available

14.7 Transport in bulk according to Annex II of MARPOL 73/78 and the IBC Code

no data available

15.Regulatory information

15.1 Safety, health and environmental regulations specific for the product in question

Chemical name Common names and synonyms CAS number EC number
1,1,2,2-Tetrabromoethane 1,1,2,2-Tetrabromoethane 79-27-6 none
European Inventory of Existing Commercial Chemical Substances (EINECS) Listed.
EC Inventory Listed.
United States Toxic Substances Control Act (TSCA) Inventory Listed.
China Catalog of Hazardous chemicals 2015 Listed.
New Zealand Inventory of Chemicals (NZIoC) Listed.
Philippines Inventory of Chemicals and Chemical Substances (PICCS) Listed.
Vietnam National Chemical Inventory Not Listed.
Chinese Chemical Inventory of Existing Chemical Substances (China IECSC) Listed.

16.Other information

Information on revision

Creation Date Aug 12, 2017
Revision Date Aug 12, 2017

Abbreviations and acronyms

  • CAS: Chemical Abstracts Service
  • ADR: European Agreement concerning the International Carriage of Dangerous Goods by Road
  • RID: Regulation concerning the International Carriage of Dangerous Goods by Rail
  • IMDG: International Maritime Dangerous Goods
  • IATA: International Air Transportation Association
  • TWA: Time Weighted Average
  • STEL: Short term exposure limit
  • LC50: Lethal Concentration 50%
  • LD50: Lethal Dose 50%
  • EC50: Effective Concentration 50%

References

  • IPCS - The International Chemical Safety Cards (ICSC), website: http://www.ilo.org/dyn/icsc/showcard.home
  • HSDB - Hazardous Substances Data Bank, website: https://toxnet.nlm.nih.gov/newtoxnet/hsdb.htm
  • IARC - International Agency for Research on Cancer, website: http://www.iarc.fr/
  • eChemPortal - The Global Portal to Information on Chemical Substances by OECD, website: http://www.echemportal.org/echemportal/index?pageID=0&request_locale=en
  • CAMEO Chemicals, website: http://cameochemicals.noaa.gov/search/simple
  • ChemIDplus, website: http://chem.sis.nlm.nih.gov/chemidplus/chemidlite.jsp
  • ERG - Emergency Response Guidebook by U.S. Department of Transportation, website: http://www.phmsa.dot.gov/hazmat/library/erg
  • Germany GESTIS-database on hazard substance, website: http://www.dguv.de/ifa/gestis/gestis-stoffdatenbank/index-2.jsp
  • ECHA - European Chemicals Agency, website: https://echa.europa.eu/

Disclaimer: The above information is believed to be correct but does not purport to be all inclusive and shall be used only as a guide. The information in this document is based on the present state of our knowledge and is applicable to the product with regard to appropriate safety precautions. It does not represent any guarantee of the properties of the product. We as supplier shall not be held liable for any damage resulting from handling or from contact with the above product.
MSDS
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Name: 1 1 2 2-Tetrabromoethane Material Safety Data Sheet
Synonym: Acetylene tetrabromide; TBE
CAS: 79-27-6
Section 1 - Chemical Product   MSDS Name:1 1 2 2-Tetrabromoethane Material Safety Data Sheet
Synonym:Acetylene tetrabromide; TBE

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# Chemical Name content EINECS#
79-27-6 1,1,2,2-Tetrabromoethane 100 201-191-5
Hazard Symbols: T+
Risk Phrases: 26 36 52/53

Section 3 - HAZARDS IDENTIFICATION
  EMERGENCY OVERVIEW
Very toxic by inhalation. Irritating to eyes. Harmful to aquatic organisms, may cause long-term adverse effects in the aquatic environment.Possible risks of irreversible effects.
Potential Health Effects
Eye:
Contact with eyes may cause severe irritation, and possible eye burns.
Skin:
May be absorbed through damaged or abraded skin in harmful amounts.
Exposure may cause irritation and possible burns. Causes symptoms similar to those of inhalation.
Ingestion:
Harmful if swallowed. Causes gastrointestinal irritation with nausea, vomiting and diarrhea. May cause liver and kidney damage.
Inhalation:
May be fatal if inhaled. Causes respiratory tract irritation. May cause liver and kidney damage. Exposure produces central nervous system depression. May cause lung damage. May cause headache, loss of appetite, nausea, fatigue, abdominal pain, darkened urine and jaundice.
Chronic:
May cause liver and kidney damage. Prolonged or repeated exposure may cause nausea, dizziness, and headache.

Section 4 - FIRST AID MEASURES
  Eyes: Immediately flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately.
Skin:
Get medical aid immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Call a poison control center. If swallowed, do not induce vomiting unless directed to do so by medical personnel. Never give anything by mouth to an unconscious person. Get medical aid.
Inhalation:
Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen.
Notes to Physician:
Monitor liver function closely.

Section 5 - FIRE FIGHTING MEASURES
  General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Vapors may be heavier than air. They can spread along the ground and collect in low or confined areas. Containers may explode when heated. Runoff from fire control or dilution water may cause pollution.
Extinguishing Media:
Substance is noncombustible; use agent most appropriate to extinguish surrounding fire.

Section 6 - ACCIDENTAL RELEASE MEASURES
  General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Avoid runoff into storm sewers and ditches which lead to waterways. Clean up spills immediately, observing precautions in the Protective Equipment section. Provide ventilation.

Section 7 - HANDLING and STORAGE
  Handling:
Wash thoroughly after handling. Avoid contact with eyes, skin, and clothing. Avoid ingestion and inhalation. Use only in a chemical fume hood.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Keep away from metals. Poison room locked. Store away from alkalies. Separate from oxidizing materials.

Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
  Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate general or local exhaust ventilation to keep airborne concentrations below the permissible exposure limits.
Exposure Limits CAS# 79-27-6: United Kingdom, WEL - TWA: 0.5 ppm TWA; 7.2 mg/m3 TWA United Kingdom, WEL - STEL: 1.5 ppm STEL; 21.6 mg/m3 STEL United States OSHA: 1 ppm TWA; 14 mg/m3 TWA Belgium - TWA: 1 ppm VLE; 14 mg/m3 VLE France - VME: 1 ppm VME; 15 mg/m3 VME Germany: 1 ppm TWA; 14 mg/m3 TWA Malaysia: 1 ppm TWA; 14 mg/m3 TWA Netherlands: 0.5 ppm MAC; 7 mg/m3 MAC Spain: 1 ppm VLA-ED; 14 mg/m3 VLA-ED Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate gloves to prevent skin exposure.
Clothing:
Wear appropriate protective gloves and clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
 
Physical State: Liquid
Color: yellow
Odor: camphor
pH: Not available.
Vapor Pressure: .1 mm Hg @68F
Viscosity: Not available.
Boiling Point: 471 deg F
Freezing/Melting Point: 32 deg F
Autoignition Temperature: 635 deg F ( 335.00 deg C)
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature: Not available.
Solubility in water: Insoluble in water.
Specific Gravity/Density: 2.96 (water=1)
Molecular Formula: C2H2Br4
Molecular Weight: 345.63

Section 10 - STABILITY AND REACTIVITY
  Chemical Stability:
Stable.
Conditions to Avoid:
High temperatures.
Incompatibilities with Other Materials:
Strong oxidizers, strong bases, and metals such as aluminum, magnesium, and zinc in the presence of steam. Will attack some forms of plastics, rubber,and coatings.
Hazardous Decomposition Products:
Hydrogen bromide, bromine fumes, carbonyl bromide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
  RTECS#:
CAS# 79-27-6: KI8225000 LD50/LC50:
CAS# 79-27-6: Draize test, rabbit, eye: 100 mg Mild; Draize test, rabbit, skin: 500 mg/24H Moderate; Inhalation, rat: LC50 = 549 mg/m3/4H; Inhalation, rat: LC50 = 550 mg/m3; Oral, mouse: LD50 = 269 mg/kg; Oral, rabbit: LD50 = 400 mg/kg; Oral, rat: LD50 = 1200 mg/kg; Skin, rat: LD50 = 5250 mg/kg.
Carcinogenicity:
1,1,2,2-Tetrabromoethane - Not listed by ACGIH, IARC, or NTP.
Other:
See actual entry in RTECS for complete information.

Section 12 - ECOLOGICAL INFORMATION
  Other No information available.

Section 13 - DISPOSAL CONSIDERATIONS
  Dispose of in a manner consistent with federal, state, and local regulations.

Section 14 - TRANSPORT INFORMATION
 
IATA
Shipping Name: TETRABROMOETHANE
Hazard Class: 6.1
UN Number: 2504
Packing Group: III
IMO
Shipping Name: TETRABROMOETHANE
Hazard Class: 6.1
UN Number: 2504
Packing Group: III
RID/ADR
Shipping Name: TETRABROMOETHANE
Hazard Class: 6.1
UN Number: 2504
Packing group: III

Section 15 - REGULATORY INFORMATION
 
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: T+
Risk Phrases:
R 26 Very toxic by inhalation.
R 36 Irritating to eyes.
R 52/53 Harmful to aquatic organisms, may cause
long-term adverse effects in the aquatic environment.
Safety Phrases:
S 24 Avoid contact with skin.
S 27 Take off immediately all contaminated clothing.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
S 61 Avoid release to the environment. Refer to
special instructions/safety data sheets.
WGK (Water Danger/Protection)
CAS# 79-27-6: No information available.
Canada
CAS# 79-27-6 is listed on Canada's DSL List.
CAS# 79-27-6 is listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 79-27-6 is listed on the TSCA inventory.


SECTION 16 - ADDITIONAL INFORMATION
N/A

Spectrum

NMR Spectrum 1H NMR : Predict
expand collapse

Analysis Methods

Kovats' RI, non-polar column, isothermal
expand collapse
Column Shape
Packed
Active Phase(℃)
OV-1
Retention index
1226.
Temperature Control
100.
Method
isothermal
Comments
He, Chromosorb W DMCS; Column length: 3. m
Reference
Castello, G.Gerbino, T.C.Effect of Temperature on the Gas Chromatographic Separation of Halogenated Compounds on Polar and Non-Polar Stationary PhasesJ. Chromatogr.1988, 437, 33-45.
Kovats' RI, non-polar column, isothermal
expand collapse
Column Shape
Packed
Active Phase(℃)
OV-1
Retention index
1245.
Temperature Control
125.
Method
isothermal
Comments
He, Chromosorb W DMCS; Column length: 3. m
Reference
Castello, G.Gerbino, T.C.Effect of Temperature on the Gas Chromatographic Separation of Halogenated Compounds on Polar and Non-Polar Stationary PhasesJ. Chromatogr.1988, 437, 33-45.
Kovats' RI, non-polar column, isothermal
expand collapse
Column Shape
Packed
Active Phase(℃)
OV-1
Retention index
1206.
Temperature Control
75.
Method
isothermal
Comments
He, Chromosorb W DMCS; Column length: 3. m
Reference
Castello, G.Gerbino, T.C.Effect of Temperature on the Gas Chromatographic Separation of Halogenated Compounds on Polar and Non-Polar Stationary PhasesJ. Chromatogr.1988, 437, 33-45.
Kovats' RI, non-polar column, isothermal
expand collapse
Column Shape
Packed
Active Phase(℃)
SE-30
Retention index
1265.
Temperature Control
150.
Method
isothermal
Comments
Ar, Gas Chrom Q (80-100 mesh); Column length: 3. m
Reference
Tiess, D.Gaschromatographische Retentionsindices von 125 leicht- bis mittelflüchtigen organischen Substanzen toxikologisch-analytischer Relevanz auf SE-30Wiss. Z. Wilhelm-Pieck-Univ. Rostock Math. Naturwiss. Reihe1984, 33, 6-9.
Normal alkane RI, non-polar column, custom temperature program
expand collapse
Column Shape
Capillary
Active Phase(℃)
OV-1, SE-30, Methyl silicone, SP-2100, OV-101, DB-1, etc.
Retention index
1269.
Temperature Control
Method
custom temperature program
Comments
Hydrogen; Column length: 50. m; Column diameter: 0.32 mm; Program: not specified
Reference
Waggott, A.Davies, I.W.Identification of organic pollutants using linear temperature programmed retention indices (LTPRIs) - Part II1984, retrieved from http://dwi.defra.gov.uk/research/completed-research/reports/dwi0383.pdf.

Synthesis Route

Related Compound Information