Vitas-M small molecule compound
3-[(3-chlorophenyl)amino]-5,5-dimethylcyclohex-2-en-1-one
Catalog ID
STK261339
SMILES O=C1C=C(Nc2cccc(c2)Cl)CC(C1)(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 C14H16ClNO MW 249.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H16ClNO/c1-14(2)8-12(7-13(17)9-14)16-11-5-3-4-10(15)6-11/h3-7,16H,8-9H2,1-2H3InChIKey
CEQJQTUWWPLELV-UHFFFAOYSA-NSynonyms
50685-29-53((3CHLOROPHENYL)AMINO)55DIMETHYLCYCLOHEX2EN1ONE
3(3CHLOROANILINO)55DIMETHYL2CYCLOHEXENE1ONE
3(3CHLOROANILINO)55DIMETHYLCYCLOHEX2EN1ONE
50685295
CC1(CC(=CC(=O)C1)NC2=CC(=CC=C2)Cl)C
InChI=1SC14H16ClNOc114(2)812(713(17)914)161153410(15)611h3716H89H212H3
MFCD00156401
ZINC000000563157
ZINC00563157
ZINC563157
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