Vitas-M small molecule compound
methyl 3,3,3-trifluoro-2-hydroxy-2-(3-methyl-4-{[(pentafluorophenyl)carbonyl]amino}phenyl)propanoate
Catalog ID
STK786758
SMILES COC(=O)C(C(F)(F)F)(c1ccc(c(c1)C)NC(=O)c1c(F)c(F)c(c(c1F)F)F)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 C18H11F8NO4 MW 457.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11F8NO4/c1-6-5-7(17(30,16(29)31-2)18(24,25)26)3-4-8(6)27-15(28)9-10(19)12(21)14(23)13(22)11(9)20/h3-5,30H,1-2H3,(H,27,28)InChIKey
TWXMAFXPOIQKBD-UHFFFAOYSA-NSynonyms
355147-24-9355147249
CC1=C(C=CC(=C1)C(C(=O)OC)(C(F)(F)F)O)NC(=O)C2=C(C(=C(C(=C2F)F)F)F)F
InChI=1SC18H11F8NO4c1657(17(3016(29)312)18(2425)26)348(6)2715(28)910(19)12(21)14(23)13(22)11(9)20h3530H12H3(H2728)
methyl333trifluoro2hydroxy2(3methyl4(((pentafluorophenyl)carbonyl)amino)phenyl)propanoate
methyl333trifluoro2hydroxy2(3methyl4((23456pentafluorobenzoyl)amino)phenyl)propanoate
methyl333trifluoro2hydroxy2(3methyl4(perfluorobenzamido)phenyl)propanoate
MFCD01561689
ZINC000002871806
ZINC000002871807
Check stock
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Check stock on Vitas-MAvailable files
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