Vitas-M small molecule compound
2-(cyanomethyl)benzoic acid
Catalog ID
STK523958
SMILES N#CCc1ccccc1C(=O)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C9H7NO2 MW 161.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H7NO2/c10-6-5-7-3-1-2-4-8(7)9(11)12/h1-4H,5H2,(H,11,12)InChIKey
AGXBHBJDSLZGAP-UHFFFAOYSA-NSynonyms
6627-91-42(cyanomethyl)benzoicacid
2CYANOMETHYLBENZOICACID
6627914
ALPHACYANOOTOLUICACID
BENZOICACID2(CYANOMETHYL)
C1=CC=C(C(=C1)CC#N)C(=O)O
InChI=1SC9H7NO2c1065731248(7)9(11)12h14H5H2(H1112)
MFCD00020293
OCARBOXYPHENYLACETONITRILE
OCYANOMETHYLBENZOICACID
OTOLUICACIDALPHACYANO
ZINC000001301233
ZINC1301233
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