(4-Cyanophenyl)acetic acid

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Names

[ CAS No. ]:
5462-71-5

[ Name ]:
(4-Cyanophenyl)acetic acid

[Synonym ]:
4-cyanophenylacetic acid
MFCD06798066
Benzeneacetic acid, 4-cyano-
EINECS 226-753-7
(4-Cyanophenyl)acetic acid

Chemical & Physical Properties

[ Density]:
1.3±0.1 g/cm3

[ Boiling Point ]:
355.2±25.0 °C at 760 mmHg

[ Melting Point ]:
150-154ºC

[ Molecular Formula ]:
C9H7NO2

[ Molecular Weight ]:
161.157

[ Flash Point ]:
168.6±23.2 °C

[ Exact Mass ]:
161.047684

[ PSA ]:
61.09000

[ LogP ]:
0.94

[ Appearance of Characters ]:
Powder | White to pale brown

[ Vapour Pressure ]:
0.0±0.8 mmHg at 25°C

[ Index of Refraction ]:
1.577

[ Water Solubility ]:
Soluble in CHCl3, THF, dioxane.

MSDS

Safety Information

[ Symbol ]:

GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H302-H315-H319

[ Precautionary Statements ]:
P305 + P351 + P338

[ Personal Protective Equipment ]:
dust mask type N95 (US);Eyeshields;Gloves

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R22;R36/38

[ Safety Phrases ]:
S26

[ RIDADR ]:
UN3439

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
6.1

[ HS Code ]:
2926909090

Synthetic Route

Precursor & DownStream

Precursor

  • (4-Aminophenyl)acetic acid
  • 4-(2-Hydroxyethyl)benzonitrile
  • zinc,dicyanide
  • 4-Bromophenylacetic acid
  • 4-Cyanophenylacetonitrile
  • carbon monoxide
  • 4-Cyanobenzyl bromide
  • Carbon dioxide
  • 4-(2-OXO-2-(PYRROLIDIN-1-YL)ETHYL)BENZONITRILE

DownStream

  • 4-(2-OXO-2-PHENYLETHYL)BENZOIC ACID
  • Methyl (4-cyanophenyl)acetate
  • ETHYL 4-(2-OXO-2-PHENYLETHYL)BENZOATE
  • 2-(4-formylphenyl)acetic acid
  • 4-Cyanobenzaldehyde
  • 4-Stilbenecarbonitrile, (E)-
  • ETHYL 4-CYANOPHENYLACETATE
  • 4-(1,3-dioxoinden-2-yl)benzonitrile
  • 4-[2-[4-(4-cyanophenoxy)phenyl]-2-oxoethyl]-3-nitrobenzonitrile
  • 6-(4,5-dihydro-1H-imidazol-2-yl)-2-[4-[4-(4,5-dihydro-1H-imidazol-2-yl)phenoxy]phenyl]-1H-indole,hydrochloride

Customs

[ HS Code ]: 2926909090

[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%


Related Compounds

  • 4-Cyanophenylacetic Acid
  • 4-cyanophenylacetic acid chloride
  • 2-Cyanophenylacetic acid
  • ETHYL 4-CYANOPHENYLACETATE
  • 4-Cyanobenzoic acid
  • 4-methylbenzenesulfonic acid,2-(4-phenoxyphenyl)ethanol