Vitas-M small molecule compound
di-tert-butyl 4-hydroxy-2-[4-(methoxycarbonyl)phenyl]-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STK842682
SMILES COC(=O)c1ccc(cc1)C1C(C(=O)OC(C)(C)C)C(=O)CC(C1C(=O)OC(C)(C)C)(C)O
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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 C25H34O8 MW 462.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34O8/c1-23(2,3)32-21(28)18-16(26)13-25(7,30)19(22(29)33-24(4,5)6)17(18)14-9-11-15(12-10-14)20(27)31-8/h9-12,17-19,30H,13H2,1-8H3InChIKey
NWQZSXJTPDQDFV-UHFFFAOYSA-NSynonyms
1005090-02-71005090027
CC1(CC(=O)C(C(C1C(=O)OC(C)(C)C)C2=CC=C(C=C2)C(=O)OC)C(=O)OC(C)(C)C)O
ditertbutyl4hydroxy2(4(methoxycarbonyl)phenyl)4methyl6oxocyclohexane13dicarboxylate
DITERTBUTYL4HYDROXY2(4METHOXYCARBONYLPHENYL)4METHYL6OXOCYCLOHEXANE13DICARBOXYLATE
InChI=1SC25H34O8c123(23)3221(28)1816(26)1325(730)19(22(29)3324(45)6)17(18)1491115(121014)20(27)318h912171930H13H218H3
MFCD03288990
ZINC000013563584
ZINC000245296670
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