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2-(CYANOMETHYL)BENZOIC ACID
  • Chemical Name: 2-(CYANOMETHYL)BENZOIC ACID
  • CAS No.: 6627-91-4

2-(CYANOMETHYL)BENZOIC ACID 6627-91-4 with purity >99% Low price in stock

  • Molecular Formula: C9H6NO2-
  • Molecular Weight: 161.16
  • Vapor Pressure: 1.84E-05mmHg at 25°C 
  • Melting Point: 126 °C 
  • Boiling Point: 348.8°Cat760mmHg 
  • PKA: 3.66±0.36(Predicted) 
  • Flash Point: 164.8°C 
  • PSA: 61.09000 
  • Density: 1.257g/cm3 
  • LogP: 1.45088 

2-(CYANOMETHYL)BENZOIC ACID(Cas 6627-91-4) Usage

Purification Methods

Crystallise the nitrile (with considerable loss) from *benzene, glacial acetic acid or H2O. The methyl ester has m 47-48o (from *C6H6). [Price & Rogers Org Synth Coll Vol III 174 1955, Beilstein 9 H 859, 9 II 618, 9 III 4267.]

InChI:InChI=1/C9H7NO2/c10-6-5-7-3-1-2-4-8(7)9(11)12/h1-4H,5H2,(H,11,12)/p-1

6627-91-4 Relevant articles

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Hydroformylation

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6627-91-4 Process route

2-Hydroxyimino-1-indanon
80070-33-3

2-Hydroxyimino-1-indanon

2-cyanomethylbenzoic acid
6627-91-4

2-cyanomethylbenzoic acid

Conditions
Conditions Yield
2-Hydroxyimino-1-indanon; With sodium hydroxide; In water; at 50 ℃;
With p-toluenesulfonyl chloride; In water;
With hydrogenchloride; In water; pH=3 - 4;
74%
(2-carbethoxyphenyl)acetonitrile
19821-21-7

(2-carbethoxyphenyl)acetonitrile

2-cyanomethylbenzoic acid
6627-91-4

2-cyanomethylbenzoic acid

Conditions
Conditions Yield
With sodium hydroxide; at 40 ℃; for 5h;
94%

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