phenylacetic acid

CAS No. 103-82-2

Formula: C8H8O2
Basic Info

Phenylacetic Acid is used in the synthesis of Diclofenac and its metabolite 4'-Hydroxydiclofenac, which is the principal human metabolite of Diclofenac.

Formula
C8H8O2
Molecular Weight
136.148
Exact Mass
136.052
LogP
1.3137
PSA
37.3
Synonyms

phenylethanoic acid

Benzeneacetic acid

Benzylzinc bromide 0.5 M in Tetrahydrofuran

Phenylacetic acid

benzyl zinc bromide

benzylic zinc bromide

Benzylzinc bromide solution

benzylcarboxylic acid

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Properties
Appearance & Physical State
white crystals with a honey-like odour
Density
1.081
Boiling Point
265ºC
Melting Point
75-78ºC
Flash Point
132ºC
Refractive Index
1.50246 (79.8ºC)
Water Solubility
15 g/L (20 ºC)
Stability
Stable. Incompatible with strong oxidizing agents.
Storage Condition
Store at RT.
Vapor Density
~4 (vs air)
Vapor Pressure
1 mm Hg ( 97 °C)
Safety Info
RTECS
AJ2430000
Safety Statements
S26-S37/39
WGK Germany
1
Risk Statements
R36/37/38
HS Code
2916340010
Packing Group
III
Hazard Codes
Spectrum
NMR Spectrum 13C NMR : in CDCl3
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Mass Spectrum Mass spectrum (electron ionization)
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ESR Spectrum ESR : REDUCTION WITH MIXTURE OF TI AND H2O2
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UV Spectrum UV/Visible spectrum
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Related Compound Information

PRODUCTS
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SUPPLIERS
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BRANDING
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