Vitas-M small molecule compound
dimethyl 2-(4-ethylphenyl)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate
Catalog ID
STL334698
SMILES CCc1ccc(cc1)C1C(C(=O)OC)C(=O)CC(C1C(=O)OC)(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 C19H24O6 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24O6/c1-5-11-6-8-12(9-7-11)14-15(17(21)24-3)13(20)10-19(2,23)16(14)18(22)25-4/h6-9,14-16,23H,5,10H2,1-4H3InChIKey
KMYYBZLECFIGBN-UHFFFAOYSA-NSynonyms
1005147-04-51005147045
CCC1=CC=C(C=C1)C2C(C(=O)CC(C2C(=O)OC)(C)O)C(=O)OC
dimethyl2(4ethylphenyl)4hydroxy4methyl6oxocyclohexane13dicarboxylate
InChI=1SC19H24O6c15116812(9711)1415(17(21)243)13(20)1019(223)16(14)18(22)254h69141623H510H214H3
MFCD03296641
ZINC000004903966
ZINC000239331342
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