Methyl 3-cyanobenzoate, 95%

cas: 13531-48-1 — see every product listed under this CAS number, including other names

Methyl 3-cyanobenzoate, 95% (CAS 13531-48-1) is a chemical reagent available from Chemat. Available pack sizes: 1g, 10g. Offered by: Thermo Scientific.

• 2D
• 3D

Methyl 3-cyanobenzoate is a benzoate ester.

Source: ChEBI

Identity

Molecular formula	C9H7NO2
Molecular weight	161.16 g/mol
IUPAC name	methyl 3-cyanobenzoate
InChIKey	XPBHWSMZTSSEJE-UHFFFAOYSA-N
SMILES	COC(=O)C1=CC=CC(=C1)C#N

Computed by PubChem (NCBI)

Synonyms: methyl 3-cyanobenzoate, Benzoic acid, 3-cyano-, methyl ester, Methyl m-cyanobenzoate, InChI=1/C9H7NO2/c1-12-9(11)8-4-2-3-7(5-8)6-10/h2-5H,1H, 3-Cyanobenzoic acid methyl ester, methyl-3-cyanobenzoate, 3-cyano-benzoic acid methyl ester, orb3030454, Fr13841

Isomers (same molecular formula)

1-(3-isocyanatophenyl)ethanone C₉H₇NO₂

2-hydroxyimino-3H-inden-1-one C₉H₇NO₂

2-hydroxy-1H-indole-3-carbaldehyde C₉H₇NO₂

6-hydroxy-2H-isoquinolin-1-one C₉H₇NO₂

methyl 2-ethynylpyridine-4-carboxylate C₉H₇NO₂

3-acetyl-2-hydroxybenzonitrile C₉H₇NO₂

1H-indole-5-carboxylic acid C₉H₇NO₂

2-oxo-1,3-dihydroindole-5-carbaldehyde C₉H₇NO₂

4-hydroxy-1H-indole-3-carbaldehyde C₉H₇NO₂

2-ethynyl-1-methyl-4-nitrobenzene C₉H₇NO₂

3-cyano-2-methylbenzoic acid C₉H₇NO₂

methyl 5-ethynylpyridine-3-carboxylate C₉H₇NO₂