Vitas-M small molecule compound

2,2'-(phenylmethanediyl)bis(5,5-dimethylcyclohexane-1,3-dione)

Catalog ID
STK059603
SMILES O=C1CC(C)(C)CC(=O)C1C(C1C(=O)CC(CC1=O)(C)C)c1ccccc1

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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 C23H28O4 MW 368.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28O4/c1-22(2)10-15(24)20(16(25)11-22)19(14-8-6-5-7-9-14)21-17(26)12-23(3,4)13-18(21)27/h5-9,19-21H,10-13H2,1-4H3
InChIKey
HLVZCZIDSROVCO-UHFFFAOYSA-N
Synonyms
19419-23-9
13CYCLOHEXANEDIONE22BENZYLIDENEBIS(55DIMETHYL
19419239
2((44DIMETHYL26DIOXOCYCLOHEXYL)(PHENYL)METHYL)55DIMETHYLCYCLOHEXANE13DIONE
2((44DIMETHYL26DIOXOCYCLOHEXYL)PHENYLMETHYL)55DIMETHYLCYCLOHEXANE13DIONE
22(PHENYLMETHANEDIYL)BIS(55DIMETHYLCYCLOHEXANE13DIONE)
22(phenylmethylene)bis(55dimethylcyclohexane13dione)
CC1(CC(=O)C(C(=O)C1)C(C2C(=O)CC(CC2=O)(C)C)C3=CC=CC=C3)C
InChI=1SC23H28O4c122(2)1015(24)20(16(25)1122)19(148657914)2117(26)1223(34)1318(21)27h591921H1013H214H3
METHANEBIS(44DIMETHYL13DIOXOCYCLOHEXYL)PHENYL
MFCD00358334
O=C1CC(C)(C)CC(=O)C1C(C1C(=O)CC(CC1=O)(C)C)c1ccccc1
PHENYLMETHANEBI(44DIMETHYLCYCLOHEXAN26DIONE1YL)
STK059603
TETRAKETONE2
ZINC000004728776
ZINC04728776
ZINC4728776

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Available files

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