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3-(1-Cyanoethyl)Benzoic Acid

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3-(1-Cyanoethyl)Benzoic Acid / CAS : 5537-71-3

Appearance It is a solid at room temperature UN -
HS 29269090 DG Class -
Synonyms M-(1-Cyanoethyl)Benzoic Acid; Benzoic Acid, 3-(1-Cyanoethyl)-; 3,1 CYNO Ethyl Benzoic ACID
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Properties

Summary

Formula
C10H9NO2
Molecular Mass
175.18400
Exact Mass
175.06300
PSA
61.09000
Logp
1.84098
IUPAC
3-(1-cyanoethyl)benzoic acid
SMILES
CC(C#N)C1=CC(=CC=C1)C(=O)O

Attribute classification

Matter Classification
organic
Category
API & Intermediate > Pharmaceutical Intermediates
Auxiliary > Other Auxiliary Agent

Chemical and Physical Properties

Melting Point
143-145 °C
Density
1.204g/cm3#
Boiling Point
355.8ºC
Flash Point
169ºC
Appearance
It is a solid at room temperature

Export information

HS Code
29269090
Export Rebate
13%
Risk Code
R22; R41; R43
Safety Label
Xn

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