Vitas-M small molecule compound
diethyl 4-chloro-5-(phenylsulfinyl)cyclohexane-1,2-dicarboxylate
Catalog ID
STK786521
SMILES CCOC(=O)C1CC(C(CC1C(=O)OCC)Cl)S(=O)c1ccccc1
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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 C18H23ClO5S MW 386.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23ClO5S/c1-3-23-17(20)13-10-15(19)16(11-14(13)18(21)24-4-2)25(22)12-8-6-5-7-9-12/h5-9,13-16H,3-4,10-11H2,1-2H3InChIKey
CMYFIVFGISYXSM-UHFFFAOYSA-NSynonyms
CCOC(=O)C1CC(C(CC1C(=O)OCC)Cl)S(=O)C2=CC=CC=C2
diethyl4(benzenesulfinyl)5chlorocyclohexane12dicarboxylate
diethyl4chloro5(phenylsulfinyl)cyclohexane12dicarboxylate
InChI=1SC18H23ClO5Sc132317(20)131015(19)16(1114(13)18(21)2442)25(22)128657912h591316H341011H212H3
MFCD09062671
ZINC000230065014
ZINC000245254846
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