Methyl 3-cyanobenzoate Chemical 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 Information

Hazard Codes 

Xn

Risk Statements 

20/21/22

Safety Statements 

22-26-36/37/39

HS Code 

2916399090

Methyl 3-cyanobenzoate Usage And Synthesis

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).

Definition

ChEBI: Methyl 3-cyanobenzoate is a benzoate ester.

Methyl 3-cyanobenzoate(13531-48-1)Related Product Information

• METHYL ISOCYANOACETATE
• Methylparaben
• 3-Cyanobenzoic acid
• Methyl acetate
• Thiophanate-methyl
• Methyl benzoate
• Pirimiphos-methyl
• METSULFURON METHYL
• Kresoxim-methyl
• Methyl salicylate
• Tribenuron methyl
• Methyl cyanoacetate
• Methyl 3-cyclopentenecarboxylate
• 3-CYANOPROPIONIC ACID METHYL ESTER
• Methyl 3-cyclopropyl-3-oxopropionate
• Methyl
• Methyl bromide
• METHYL 3-CYANO-4-METHOXYBENZOATE