Vitas-M small molecule compound

3-amino-4-methylbenzoic acid

Catalog ID
STK498489
SMILES OC(=O)c1ccc(c(c1)N)C

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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 C8H9NO2 MW 151.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H9NO2/c1-5-2-3-6(8(10)11)4-7(5)9/h2-4H,9H2,1H3,(H,10,11)
InChIKey
XKFIFYROMAAUDL-UHFFFAOYSA-N
Synonyms
2458-12-0
2458120
3amino4methylbenzoicacid
3AMINOPTOLUICACID
BENZOICACID3AMINO4METHYL
CC1=C(C=C(C=C1)C(=O)O)N
InChI=1SC8H9NO2c15236(8(10)11)47(5)9h24H9H21H3(H1011)
MFCD00007742
ZINC000000164385
ZINC164385

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Available files

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