Vitas-M small molecule compound
methyl 3-chloro-2-hydroxy-4-[(4-methylphenyl)amino]-4-oxo-2-(trifluoromethyl)butanoate
Catalog ID
STL169311
SMILES COC(=O)C(C(F)(F)F)(C(C(=O)Nc1ccc(cc1)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 C13H13ClF3NO4 MW 339.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClF3NO4/c1-7-3-5-8(6-4-7)18-10(19)9(14)12(21,11(20)22-2)13(15,16)17/h3-6,9,21H,1-2H3,(H,18,19)InChIKey
DNNJZPZUNRYWFG-UHFFFAOYSA-NSynonyms
404848-44-8404848448
CC1=CC=C(C=C1)NC(=O)C(C(C(=O)OC)(C(F)(F)F)O)Cl
InChI=1SC13H13ClF3NO4c17358(647)1810(19)9(14)12(2111(20)222)13(1516)17h36921H12H3(H1819)
methyl3chloro2hydroxy4((4methylphenyl)amino)4oxo2(trifluoromethyl)butanoate
METHYL3CHLORO2HYDROXY4(4METHYLANILINO)4OXO2(TRIFLUOROMETHYL)BUTANOATE
METHYL3CHLORO2HYDROXY4OXO4(4TOLUIDINO)2(TRIFLUOROMETHYL)BUTANOATE
MFCD02243584
ZINC000002769395
ZINC000002769398
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