Vitas-M small molecule compound
2,2,2-trifluoroethyl 5-[(4-chlorophenyl)amino]-5-oxopentanoate
Catalog ID
STK500568
SMILES O=C(Nc1ccc(cc1)Cl)CCCC(=O)OCC(F)(F)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 C13H13ClF3NO3 MW 323.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13ClF3NO3/c14-9-4-6-10(7-5-9)18-11(19)2-1-3-12(20)21-8-13(15,16)17/h4-7H,1-3,8H2,(H,18,19)InChIKey
QSYXKWBGJQEXOE-UHFFFAOYSA-NSynonyms
222trifluoroethyl5((4chlorophenyl)amino)5oxopentanoate
222trifluoroethyl5(4chloroanilino)5oxopentanoate
C1=CC(=CC=C1NC(=O)CCCC(=O)OCC(F)(F)F)Cl
InChI=1SC13H13ClF3NO3c1494610(759)1811(19)21312(20)21813(1516)17h47H138H2(H1819)
MFCD01603586
ZINC000005769727
ZINC05769727
ZINC5769727
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