S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] (1R-cis)-ethanethioate

Modify Date: 2024-04-07 10:15:00

S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] (1R-cis)-ethanethioate Structure
S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] (1R-cis)-ethanethioate structure
Common Name S-[1-methyl-1-(4-methyl-2-oxocyclohexyl)ethyl] (1R-cis)-ethanethioate
CAS Number 57129-12-1 Molecular Weight 228.35100
Density N/A Boiling Point N/A
Molecular Formula C12H20O2S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name Thioacetic acid S-[1-methyl-1-((1R,4S)-4-methyl-2-oxo-cyclohexyl)-ethyl] ester

 Chemical & Physical Properties

Molecular Formula C12H20O2S
Molecular Weight 228.35100
Exact Mass 228.11800
PSA 59.44000
LogP 3.05000
InChIKey AMXPURQVAMENCC-WCBMZHEXSA-N
SMILES CC(=O)SC(C)(C)C1CCC(C)CC1=O
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