94372 <common-name>Methyl a-cyclohexylthiophen-2-acetate</common-name> <description>Methyl a-cyclohexylthiophen-2-acetate belongs to the heteroaromatic compounds, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C13H18O2S and an average molecular weight of 238.35 g/mol.</description> <cas>55504-38-6</cas> <pubchem-id>6453195</pubchem-id> <chemical-formula>C13H18O2S</chemical-formula> <weight nil="true"/> <appearance nil="true"/> <melting-point nil="true"/> <boiling-point nil="true"/> <density nil="true"/> <solubility nil="true"/> <specific-gravity nil="true"/> <flash-point nil="true"/> <vapour-pressure nil="true"/> <route-of-exposure nil="true"/> <target nil="true"/> <mechanism-of-toxicity nil="true"/> <metabolism nil="true"/> <toxicity nil="true"/> <lethaldose nil="true"/> <carcinogenicity nil="true"/> <use-source nil="true"/> <min-risk-level nil="true"/> <health-effects nil="true"/> <symptoms nil="true"/> <treatment nil="true"/> <created-at type="dateTime">2026-04-05T02:41:11Z</created-at> <updated-at type="dateTime">2026-04-05T02:41:11Z</updated-at> <interacting-proteins nil="true"/> <wikipedia nil="true"/> <uniprot-id nil="true"/> <kegg-compound-id nil="true"/> <omim-id nil="true"/> <chebi-id nil="true"/> <biocyc-id nil="true"/> <ctd-id nil="true"/> <stitch-id nil="true"/> <drugbank-id nil="true"/> <pdb-id nil="true"/> <actor-id nil="true"/> <organism nil="true"/> <export type="boolean">true</export> <metabolizing-proteins nil="true"/> <transporting-proteins nil="true"/> <moldb-smiles>COC(=O)C(C1CCCCC1)C1=CC=CS1</moldb-smiles> <moldb-formula>C13H18O2S</moldb-formula> <moldb-inchi>InChI=1/C13H18O2S/c1-15-13(14)12(11-8-5-9-16-11)10-6-3-2-4-7-10/h5,8-10,12H,2-4,6-7H2,1H3</moldb-inchi> <moldb-inchikey>MIIGKLMBGRMWLT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">238.35</moldb-average-mass> <moldb-mono-mass type="decimal">238.1027508</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id nil="true"/> <structure-image-file-name nil="true"/> <structure-image-content-type nil="true"/> <structure-image-file-size type="integer" nil="true"/> <structure-image-updated-at type="dateTime" nil="true"/> <biodb-id nil="true"/> <synthesis-reference nil="true"/> <structure-image-caption nil="true"/> <chemdb-id>CHEM090265</chemdb-id> <dsstox-id>DTXSID00970850</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00056148</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area nil="true"/> <moldb-refractivity nil="true"/> <moldb-polarizability nil="true"/> <moldb-rotatable-bond-count nil="true"/> <moldb-acceptor-count nil="true"/> <moldb-donor-count nil="true"/> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge nil="true"/> <moldb-number-of-rings nil="true"/> <moldb-alogps-logp nil="true"/> <moldb-alogps-logs nil="true"/> <moldb-alogps-solubility nil="true"/> <kingdom>Organic compounds</kingdom> <superklass>Organoheterocyclic compounds</superklass> <klass>Heteroaromatic compounds</klass> <subklass nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0149137</sync-id> <structure-inchikey>MIIGKLMBGRMWLT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>6002000000000200000000000000000000001000000000000000001000004000000000010000000000000000000000010000000000000000001000000000000000000001000000000000000000000000002000001000010000000000000000000000000001000000004000000000002000000002000000000000000000000110080000004000000080000000000000008000000000000000000000000000000000000000000c000000000000080000000000000000000800008000000000000000000001000000000000000020000000000000000000000000000200000000000000000000000000000040000000000400000000000000200000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEQAAAIABBgBgAAAAAQMIACgAAAAD AgYAKAAAAAMECAAoAAAAAwIGAGAAAAADAQYAYAAAAAMBBgBgAAAAAgIGAGAA AAACAgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgZAKAAAAAMEBkBoAAAAAwMB BkBoAAAAAwMBBkBoAAAAAwMBEEAoAAAAAwILAAEAAQIgAgMoAgIEAAQFAAUG AAYHAAcIAAgJAAkKAAQLAAsMaAwMDWgMDQ5oDA4PaAwKBQAPC2gMQgIAAAAG BgcICQoFBQwLDw4NFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:35:44Z</structure-indexed-at> </compound>