Vitas-M small molecule compound
2,2'-[(2,4-dichloro-5-nitrophenyl)methanediyl]bis(5,5-dimethylcyclohexane-1,3-dione)
Catalog ID
STL368021
SMILES O=C1CC(C)(C)CC(=O)C1C(c1cc([N+](=O)[O-])c(cc1Cl)Cl)C1C(=O)CC(CC1=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 C23H25Cl2NO6 MW 482.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25Cl2NO6/c1-22(2)7-15(27)20(16(28)8-22)19(21-17(29)9-23(3,4)10-18(21)30)11-5-14(26(31)32)13(25)6-12(11)24/h5-6,19-21H,7-10H2,1-4H3InChIKey
XKYVADHLCNLQRD-UHFFFAOYSA-NSynonyms
2((24dichloro5nitrophenyl)(44dimethyl26dioxocyclohexyl)methyl)55dimethylcyclohexane13dione
22((24dichloro5nitrophenyl)methanediyl)bis(55dimethylcyclohexane13dione)
CC1(CC(=O)C(C(=O)C1)C(C2C(=O)CC(CC2=O)(C)C)C3=CC(=C(C=C3Cl)Cl)(N+)(=O)(O))C
InChI=1SC23H25Cl2NO6c122(2)715(27)20(16(28)822)19(2117(29)923(34)1018(21)30)11514(26(31)32)13(25)612(11)24h561921H710H214H3
MFCD00608651
O=C1CC(C)(C)CC(=O)C1C(c1cc((N+)(=O)(O))c(cc1Cl)Cl)C1C(=O)CC(CC1=O)(C)C
ZINC000105965895
ZINC105965895
Check stock
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