m-(1-Cyanoethyl)benzoic acid CAS#: 5537-71-3

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m-(1-Cyanoethyl)benzoic acid

Basic information Safety Supplier Related

m-(1-Cyanoethyl)benzoic acid Basic information

Product Name:

m-(1-Cyanoethyl)benzoic acid

Synonyms:

Benzoic acid,3-(1-cyanoethyl)-
CEBA
3-(1-cyanoethyl)-benzoicaci
3-(1-Cyanoethyl)benzolcacid
3-(1-CYANOETHYL)BENZOIC ACID
3-(1-Cyanoethyl)benzoophenone
Cyano Ethyl benzoic acid
3-(1-Cyanoethyl)benzoic

CAS:

5537-71-3

MF:

C10H9NO2

MW:

175.18

EINECS:

226-897-0

Product Categories:

Pharmaceutical raw material
API
Aromatic Carboxylic Acids, Amides, Anilides, Anhydrides & Salts
C10
Carbonyl Compounds
Carboxylic Acids
Organic acids
(intermediate of ketoprofen)

Mol File:

5537-71-3.mol

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m-(1-Cyanoethyl)benzoic acid Chemical Properties

Melting point:: 145-148 °C (lit.)
Boiling point:: 355.8±25.0 °C(Predicted)
Density: 1.204±0.06 g/cm3(Predicted)
storage temp.: Sealed in dry,Room Temperature
solubility: DMSO (Slightly), Methanol (Slightly)
form: Solid
pka: 3.96±0.10(Predicted)
color: White to Off-White
CAS DataBase Reference: 5537-71-3(CAS DataBase Reference)

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Safety Information

Hazard Codes: Xn
Risk Statements: 22-41-43
Safety Statements: 26-36/37/39-36/37/38
WGK Germany: 3
HS Code: 2926907090

MSDS

Language:English Provider:SigmaAldrich

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m-(1-Cyanoethyl)benzoic acid Usage And Synthesis

Uses

3-(1-Cyanoethyl)benzoic Acid is a intermediate for the synthetic preparation of various pharmaceutical compounds. 3-(1-Cyanoethyl)benzoic Acid was used in studies examining the enantioselectivity of n itrile hydratases.

Uses

3-(1-Cyanoethyl)benzoic acid was used in screening of cobalt containing nitrile hydratases for their enantioselectivity towards wide range of chiral nitriles.

Definition

ChEBI: Benzoic acid meta-substituted with a 1-cyanoethyl group.

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