Vitas-M small molecule compound
5-[(4-fluorophenyl)amino]-3,3-dimethyl-5-oxopentanoic acid
Catalog ID
STK111024
SMILES O=C(Nc1ccc(cc1)F)CC(CC(=O)O)(C)C
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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 C13H16FNO3 MW 253.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16FNO3/c1-13(2,8-12(17)18)7-11(16)15-10-5-3-9(14)4-6-10/h3-6H,7-8H2,1-2H3,(H,15,16)(H,17,18)InChIKey
HJPPPEDTIVCLKO-UHFFFAOYSA-NSynonyms
736970-66-45((4FLUOROPHENYL)AMINO)33DIMETHYL5OXOPENTANOICACID
5(4FLUOROANILINO)33DIMETHYL5OXOPENTANOICACID
736970664
CC(C)(CC(=O)NC1=CC=C(C=C1)F)CC(=O)O
InChI=1SC13H16FNO3c113(2812(17)18)711(16)1510539(14)4610h36H78H212H3(H1516)(H1718)
MFCD00104661
ZINC000000101015
ZINC101015
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