Vitas-M small molecule compound
(6E)-6-(2,3-dichlorobenzylidene)-2,5-dimethyl-2-(propan-2-yl)cyclohexanone
Catalog ID
STL326347
SMILES CC(C1(C)CCC(/C(=C\c2cccc(c2Cl)Cl)/C1=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 C18H22Cl2O MW 325.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22Cl2O/c1-11(2)18(4)9-8-12(3)14(17(18)21)10-13-6-5-7-15(19)16(13)20/h5-7,10-12H,8-9H2,1-4H3/b14-10+InChIKey
GGHFMFVEFSJANJ-GXDHUFHOSA-NSynonyms
372152-71-1(6E)6((23DICHLOROPHENYL)METHYLIDENE)25DIMETHYL2PROPAN2YLCYCLOHEXAN1ONE
(6E)6(23DICHLOROBENZYLIDENE)25DIMETHYL2(PROPAN2YL)CYCLOHEXANONE
(E)6(23dichlorobenzylidene)2isopropyl25dimethylcyclohexanone
372152711
CC(C1(C)CCC(C(=Cc2cccc(c2Cl)Cl)C1=O)C)C
CC1CCC(C(=O)C1=CC2=C(C(=CC=C2)Cl)Cl)(C)C(C)C
InChI=1SC18H22Cl2Oc111(2)18(4)9812(3)14(17(18)21)101365715(19)16(13)20h571012H89H214H3b1410+
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