Vitas-M small molecule compound
bis(2-methylpropyl) 2-(4-bromophenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STK610688
SMILES CC(COC(=O)C1C(=O)CC(C(C1c1ccc(cc1)Br)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 C23H31BrO6 MW 483.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31BrO6/c1-13(2)11-29-21(26)19-17(25)10-23(5,28)20(22(27)30-12-14(3)4)18(19)15-6-8-16(24)9-7-15/h6-9,13-14,18-20,28H,10-12H2,1-5H3InChIKey
REAVNVMUGROIJN-UHFFFAOYSA-NSynonyms
1005252-54-91005252549
bis(2methylpropyl)2(4bromophenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
CC(C)COC(=O)C1C(C(C(CC1=O)(C)O)C(=O)OCC(C)C)C2=CC=C(C=C2)Br
DIISOBUTYL2(4BROMOPHENYL)4HYDROXY4METHYL6OXO13CYCLOHEXANEDICARBOXYLATE
diisobutyl2(4bromophenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC23H31BrO6c113(2)112921(26)1917(25)1023(528)20(22(27)301214(3)4)18(19)156816(24)9715h691314182028H1012H215H3
MFCD03300352
ZINC000008438604
ZINC000013597567
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