Vitas-M small molecule compound

3-methylbenzoic acid

Catalog ID
STK397307
SMILES Cc1cccc(c1)C(=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 C8H8O2 MW 136.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H8O2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3,(H,9,10)
InChIKey
GPSDUZXPYCFOSQ-UHFFFAOYSA-N
Synonyms
99-04-7
3METHYLBENZICACID
3METHYLBENZOICACID
99047
BENZOICACID3METHYL
BENZOICACID3METHYLBARIUMSALT
BETABETHYLBENZOICACID
BETAMETHYLBENZOICACID
CC1=CC=CC(=C1)C(=O)O
InChI=1SC8H8O2c163247(56)8(9)10h25H1H3(H910)
METAMETHYLBENZOICACID
MFCD00002523
MMETHYLBENZOICACID
ZINC000000330142
ZINC330142

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.