Ethanethioic acid, S-1-methyl-1-(methyloxocyclohexyl)ethyl ester
S-[2-(4-methyl-2-oxocyclohexyl)propan-2-yl] ethanethioate
Also Known As: Menthone-8-thioacetate|8-Acetylthio-p-menthan-3-one|S-menthone-8-thioacetate|p-Mentha-8-Thiol-3-One Acetate|8-ACETYLTHIOMENTHAN-3-ONE|(S)-Menthone 8-thioacetate|8-Acetylthio-p-menthanone-3|3-Oxo-p-menthane-8-thiyl acetate|8-(Acetylthio)-p-menthane-3-one|S-8-acetyl thio-para-menthanone-3|EINECS 260-546-2|EINECS 304-949-4|Menthone-8-thioacetate, (1R,4R)-|S-[1-methyl-1- ethyl] ethanethioate|p-Mentha-8-thiol-3-one acetate,(cis+trans)|p-Mentha-8-thiol-3-one acetate, cis + trans|2-(1-Acetylthio-1-methylethyl)-5-methylcyclohexanone|2-[2-(ACETYLSULFANYL)PROPAN-2-YL]-5-METHYLCYCLOHEXAN-1-ONE|S-[2-(4-methyl-2-oxocyclohexyl)propan-2-yl] ethanethioate|Ethanethioic acid, S-[1-methyl-1-(methyloxocyclohexyl)ethyl] ester|S-(2-(4-Methyl-2-oxocyclohexyl)propan-2-yl) ethanethioate|S-(1-Methyl-1-(4-methyl-2-oxocyclohexyl)ethyl) ethanethioate|S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] ethanethioate|Ethanethioic acid, S-(1-methyl-1-(methyloxocyclohexyl)ethyl) ester|Ethanethioic acid, S-[1-methyl-1-[(1R,4R)-4-methyl-2-oxocyclohexyl]ethyl] ester|Ethanethioic acid, S-1-methyl-1-(methyloxocyclohexyl)ethyl ester|Ethanethioic acid, S-(1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl) ester|Ethanethioic acid, S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] ester|S-(2-((1R,4S)-4-methyl-2-oxocyclohexyl)propan-2-yl) ethanethioate, rel-|S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] (1Rtrans)ethanethioate
| Molecular Formula | C12H20O2S |
|---|---|
| Molecular Weight | 228.11841 g/mol |
| LogP | 3.05 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.11841 |
| Heavy Atoms | 15 |
| Complexity | 270.8 |
Chemical Identifiers
| CAS Number | 63299-27-4 |
|---|---|
| SMILES | CC1CCC(C(=O)C1)C(C)(C)SC(=O)C |
Product Overview
Ethanethioic acid, S-1-methyl-1-(methyloxocyclohexyl)ethyl ester (CAS 63299-27-4), with molecular formula C12H20O2S and molecular weight 228.11841 g/mol. IUPAC: S-[2-(4-methyl-2-oxocyclohexyl)propan-2-yl] ethanethioate.
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