Methyl 3-cyanobenzoate

Methyl 3-cyanobenzoate Structure
CAS No.
13531-48-1
Chemical Name:
Methyl 3-cyanobenzoate
Synonyms
3-CYANOBENZOIC ACID METHYL ESTER;3-CN-C6H4-COOCH3;RARECHEM AL BF 0051;METHYL 3-CYANOBENZOATE;Methyl m-cyanobenzoate;Mehyl3-Cyanobenzaldehyde;2,7-Naphthyridin-1(6H)-one;Methyl 3-cyanobenzoate, 95+%;3-cyano-benzoicacimethylester;3-(Methoxycarbonyl)benzonitrile
CBNumber:
CB8262602
Molecular Formula:
C9H7NO2
Molecular Weight:
161.16
MOL File:
13531-48-1.mol
MSDS File:
SDS
Modify Date:
2023/9/6 17:45:48

Methyl 3-cyanobenzoate Properties

Melting point 58 °C
Boiling point 267.2±23.0 °C(Predicted)
Density 1.18±0.1 g/cm3(Predicted)
storage temp. Sealed in dry,Room Temperature
solubility Chloroform (Slightly), Methanol (Slightly)
form Solid
color White to Off-White
LogP 1.82
CAS DataBase Reference 13531-48-1(CAS DataBase Reference)
NIST Chemistry Reference 3-CN-C6H4-COOCH3(13531-48-1)
EPA Substance Registry System Benzoic acid, 3-cyano-, methyl ester (13531-48-1)

SAFETY

Risk and Safety Statements

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319-H332-H335
Precautionary statements  P261-P280-P305+P351+P338
Hazard Codes  Xn
Risk Statements  20/21/22
Safety Statements  22-26-36/37/39
HS Code  2916399090
NFPA 704
1
2 0

Methyl 3-cyanobenzoate Chemical Properties,Uses,Production

Chemical Properties

White crystal

Uses

3-Cyanobenzoic Acid Methyl Ester, is an intermediate for the synthesis of 3-Carbamoylbenzoic Acid Derivatives as Inhibitors of Human Apurinic/Apyrimidinic Endonuclease 1 (APE1). It can also be used for the preparation of 3-[5-(2-Fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoic Acid Sodium Salt (F596070).

Methyl 3-cyanobenzoate Preparation Products And Raw materials

Raw materials

Preparation Products

Global( 231)Suppliers
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Shanghai Daken Advanced Materials Co.,Ltd +86-371-66670886 China 16220 58 Inquiry
ATK CHEMICAL COMPANY LIMITED +undefined-21-51877795 China 32760 60 Inquiry
RARECHEM AL BF 0051 3-Cyanobenzok Acid Methyl Ester Mehyl3-Cyanobenzaldehyde Methyl m-cyanobenzoate 3-(Methoxycarbonyl)benzonitrile Methyl 3-cyanobenzoate, 95+% 3-CN-C6H4-COOCH3 3-cyano-benzoicacimethylester Benzoic acid, 3-cyano-, methyl ester Benzoicacid,3-cyano-,methylester METHYL 3-CYANOBENZOATE 3-Cyanobenzoate acid methyl ester 2,7-Naphthyridin-1(6H)-one 2-Propenoicacid,2-cyano-3-phenyl-,methylester,(7E)- 3-CYANOBENZOIC ACID METHYL ESTER 13531-48-1 Aromatic Esters