Vitas-M small molecule compound
methyl 3-chloro-4-[(3-fluoro-4-methylphenyl)amino]-2-hydroxy-4-oxo-2-(trifluoromethyl)butanoate
Catalog ID
STL173732
SMILES COC(=O)C(C(F)(F)F)(C(C(=O)Nc1ccc(c(c1)F)C)Cl)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 C13H12ClF4NO4 MW 357.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClF4NO4/c1-6-3-4-7(5-8(6)15)19-10(20)9(14)12(22,11(21)23-2)13(16,17)18/h3-5,9,22H,1-2H3,(H,19,20)InChIKey
DKMUMHMORVLGCA-UHFFFAOYSA-NSynonyms
515858-00-1515858001
CC1=C(C=C(C=C1)NC(=O)C(C(C(=O)OC)(C(F)(F)F)O)Cl)F
InChI=1SC13H12ClF4NO4c16347(58(6)15)1910(20)9(14)12(2211(21)232)13(1617)18h35922H12H3(H1920)
methyl3chloro4((3fluoro4methylphenyl)amino)2hydroxy4oxo2(trifluoromethyl)butanoate
METHYL3CHLORO4(3FLUORO4METHYLANILINO)2HYDROXY4OXO2(TRIFLUOROMETHYL)BUTANOATE
MFCD02244105
ZINC000002770085
ZINC000002770088
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