Vitas-M small molecule compound

3-{[4-(propan-2-yl)phenyl]amino}cyclohex-2-en-1-one

Catalog ID
STK043345
SMILES CC(c1ccc(cc1)NC1=CC(=O)CCC1)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 C15H19NO MW 229.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H19NO/c1-11(2)12-6-8-13(9-7-12)16-14-4-3-5-15(17)10-14/h6-11,16H,3-5H2,1-2H3
InChIKey
UITLCMDHFZRSSC-UHFFFAOYSA-N
Synonyms

3((4(PROPAN2YL)PHENYL)AMINO)CYCLOHEX2EN1ONE
3(4ISOPROPYLANILINO)2CYCLOHEXENE1ONE
3(4PROPAN2YLANILINO)CYCLOHEX2EN1ONE
CC(C)C1=CC=C(C=C1)NC2=CC(=O)CCC2
CC(c1ccc(cc1)NC1=CC(=O)CCC1)C
InChI=1SC15H19NOc111(2)126813(9712)161443515(17)1014h61116H35H212H3
MFCD03719668
STK043345
ZINC000000462378
ZINC00462378
ZINC462378

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.