Vitas-M small molecule compound

5-[(4-chlorophenyl)amino]-3,3-dimethyl-5-oxopentanoic acid

Catalog ID
STK113390
SMILES O=C(Nc1ccc(cc1)Cl)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 C13H16ClNO3 MW 269.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16ClNO3/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
TYHJLZKNFRLYSB-UHFFFAOYSA-N
Synonyms
737769-75-4
5((4CHLOROPHENYL)AMINO)33DIMETHYL5OXOPENTANOICACID
5(4CHLOROANILINO)33DIMETHYL5OXOPENTANOICACID
737769754
CC(C)(CC(=O)NC1=CC=C(C=C1)Cl)CC(=O)O
InChI=1SC13H16ClNO3c113(2812(17)18)711(16)1510539(14)4610h36H78H212H3(H1516)(H1718)
MFCD00176319
ZINC000000101012
ZINC101012

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Available files

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