Vitas-M small molecule compound
bis(2-methylpropyl) 2-(4-ethoxyphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STK608688
SMILES CCOc1ccc(cc1)C1C(C(=O)OCC(C)C)C(=O)CC(C1C(=O)OCC(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 C25H36O7 MW 448.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36O7/c1-7-30-18-10-8-17(9-11-18)20-21(23(27)31-13-15(2)3)19(26)12-25(6,29)22(20)24(28)32-14-16(4)5/h8-11,15-16,20-22,29H,7,12-14H2,1-6H3InChIKey
LQEIJWJNUWOURT-UHFFFAOYSA-NSynonyms
1005117-08-71005117087
bis(2methylpropyl)2(4ethoxyphenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
CCOC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OCC(C)C)(C)O)C(=O)OCC(C)C
diisobutyl2(4ethoxyphenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC25H36O7c17301810817(91118)2021(23(27)311315(2)3)19(26)1225(629)22(20)24(28)321416(4)5h8111516202229H71214H216H3
MFCD03293477
ZINC000008913930
ZINC000239339059
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Check stock on Vitas-MAvailable files
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