Vitas-M small molecule compound

4-[(2-fluoro-5-methylphenyl)amino]-4-oxobutanoic acid

Catalog ID
STK478829
SMILES Cc1cc(NC(=O)CCC(=O)O)c(cc1)F

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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 C11H12FNO3 MW 225.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H12FNO3/c1-7-2-3-8(12)9(6-7)13-10(14)4-5-11(15)16/h2-3,6H,4-5H2,1H3,(H,13,14)(H,15,16)
InChIKey
CHWRAGGSWHBHFW-UHFFFAOYSA-N
Synonyms
904766-63-8
3((2FLUORO5METHYLPHENYL)CARBAMOYL)PROPANOICACID
3(N(2FLUORO5METHYLPHENYL)CARBAMOYL)PROPANOICACID
4((2fluoro5methylphenyl)amino)4oxobutanoicacid
4(2FLUORO5METHYLANILINO)4OXOBUTANOICACID
904766638
CC1=CC(=C(C=C1)F)NC(=O)CCC(=O)O
InChI=1SC11H12FNO3c17238(12)9(67)1310(14)4511(15)16h236H45H21H3(H1314)(H1516)
MFCD06059320
ZINC000006742332
ZINC6742332

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Available files

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