Vitas-M small molecule compound
ethyl 2-chloro-3,3,3-trifluoro-N-[(pentafluorophenyl)carbonyl]alaninate
Catalog ID
STL326942
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)c1c(F)c(F)c(c(c1F)F)F)Cl
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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 C12H6ClF8NO3 MW 399.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H6ClF8NO3/c1-2-25-10(24)11(13,12(19,20)21)22-9(23)3-4(14)6(16)8(18)7(17)5(3)15/h2H2,1H3,(H,22,23)InChIKey
YRMNVTUWZMPAIT-UHFFFAOYSA-NSynonyms
372175-59-2372175592
CCOC(=O)C(C(F)(F)F)(NC(=O)C1=C(C(=C(C(=C1F)F)F)F)F)Cl
ethyl2chloro333trifluoro2((23456pentafluorobenzoyl)amino)propanoate
ethyl2chloro333trifluoro2(perfluorobenzamido)propanoate
ethyl2chloro333trifluoroN((pentafluorophenyl)carbonyl)alaninate
InChI=1SC12H6ClF8NO3c122510(24)11(1312(1920)21)229(23)34(14)6(16)8(18)7(17)5(3)15h2H21H3(H2223)
MFCD00379481
ZINC000001650007
ZINC000002275340
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