Vitas-M small molecule compound

3-[(3,4-dichlorophenyl)amino]-5,5-dimethylcyclohex-2-en-1-one

Catalog ID
STK741698
SMILES O=C1C=C(Nc2ccc(c(c2)Cl)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 C14H15Cl2NO MW 284.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15Cl2NO/c1-14(2)7-10(5-11(18)8-14)17-9-3-4-12(15)13(16)6-9/h3-6,17H,7-8H2,1-2H3
InChIKey
XAILJFZUDSJXMF-UHFFFAOYSA-N
Synonyms
362593-33-7
3((34dichlorophenyl)amino)55dimethylcyclohex2en1one
3((34dichlorophenyl)amino)55dimethylcyclohex2enone
3(34DICHLOROANILINO)55DIMETHYL2CYCLOHEXEN1ONE
3(34DICHLOROANILINO)55DIMETHYLCYCLOHEX2EN1ONE
362593337
CC1(CC(=CC(=O)C1)NC2=CC(=C(C=C2)Cl)Cl)C
InChI=1SC14H15Cl2NOc114(2)710(511(18)814)1793412(15)13(16)69h3617H78H212H3
MFCD00128474
ZINC000007009886
ZINC07009886
ZINC7009886

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Available files

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