Dibenzosuberone

CAS No. 1210-35-1

Formula: C15H12O
Basic Info

Amitriptyline impurity, a potential antidepressant compound.

Formula
C15H12O
Molecular Weight
208.255
Exact Mass
208.089
LogP
3.0162
PSA
17.07
Synonyms

5,6-dihydrodibenzo[2,1-b:2',1'-f][7]annulen-11-one

5H-Dibenzo[a,d]cyclohepten-5-one, 10,11-dihydro-

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Properties
Appearance & Physical State
Clear to yellow liquid
Density
1.156
Boiling Point
148ºC (0.3 mmHg)
Melting Point
32-34ºC
Flash Point
112ºC
Refractive Index
1.6332-1.6352
Water Solubility
insoluble
Stability
Stable under normal temperatures and pressures.
Storage Condition
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.
Vapor Pressure
6.35E-06mmHg at 25°C
Safety Info
RTECS
HP1149700
Safety Statements
S24/25
WGK Germany
3
Risk Statements
R36/37/38
HS Code
29143900
Hazard Codes
Spectrum
NMR Spectrum 1H NMR : 90 MHz in CDCl3
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IR Spectrum IR : liquid film
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Mass Spectrum Mass
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Toxicity
SKIN/EYE IRRITATION DATA
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Type of Test
Standard Draize test
Exposure Route
Administration into the eye
Species Observed
Rodent - rabbit
Dose/Duration
100 mg
Toxic Effects
--
Reference
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,186,1992
ACUTE TOXICITY DATA
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Type of Test
LD50 - Lethal dose, 50 percent kill
Exposure Route
Oral
Species Observed
Rodent - mouse
Dose/Duration
1800 uL/kg
Toxic Effects
Sense Organs and Special Senses (Eye)--ptosis<br>Behavioral--ataxia<br>Behavioral--coma
Reference
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. (Mary Ann Liebert, Inc., 1651 Third Ave., New York, NY 10128) V.1- 1990- Volume(issue)/page/year: 1,186,1992

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