Vitas-M small molecule compound

bis(2-methylpropyl) 4-hydroxy-4-methyl-6-oxo-2-phenylcyclohexane-1,3-dicarboxylate

Catalog ID
STK772586
SMILES CC(COC(=O)C1C(=O)CC(C(C1c1ccccc1)C(=O)OCC(C)C)(C)O)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 C23H32O6 MW 404.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32O6/c1-14(2)12-28-21(25)19-17(24)11-23(5,27)20(22(26)29-13-15(3)4)18(19)16-9-7-6-8-10-16/h6-10,14-15,18-20,27H,11-13H2,1-5H3
InChIKey
BRGRVHJIWQXPQK-UHFFFAOYSA-N
Synonyms
1005046-26-3
1005046263
bis(2methylpropyl)4hydroxy4methyl6oxo2phenylcyclohexane13dicarboxylate
CC(C)COC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=CC=C2
DIISOBUTYL4HYDROXY4METHYL6OXO2PHENYL13CYCLOHEXANEDICARBOXYLATE
DIISOBUTYL4HYDROXY4METHYL6OXO2PHENYLCYCLOHEXANE13DICARBOXYLATE
InChI=1SC23H32O6c114(2)122821(25)1917(24)1123(527)20(22(26)291315(3)4)18(19)1697681016h6101415182027H1113H215H3
MFCD03294208
ZINC000004615370
ZINC000013582672

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Available files

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