102702 <common-name>2-(2-Thienyl)ethyl 2-methylbutyrate</common-name> <description>2-(2-Thienyl)ethyl 2-methylbutyrate belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. This lipid-like molecule has the formula C11H16O2S and an average molecular weight of 212.31 g/mol.</description> <cas>94135-74-7</cas> <pubchem-id>3023726</pubchem-id> <chemical-formula>C11H16O2S</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">2026-04-05T09:49:57Z</created-at> <updated-at type="dateTime">2026-04-05T09:49:57Z</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>CCC(C)C(=O)OCCC1=CC=CS1</moldb-smiles> <moldb-formula>C11H16O2S</moldb-formula> <moldb-inchi>InChI=1/C11H16O2S/c1-3-9(2)11(12)13-7-6-10-5-4-8-14-10/h4-5,8-9H,3,6-7H2,1-2H3</moldb-inchi> <moldb-inchikey>XSDPFNMJFNZEIN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">212.31</moldb-average-mass> <moldb-mono-mass type="decimal">212.0871008</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>CHEM098595</chemdb-id> <dsstox-id>DTXSID00916319</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00066217</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>Lipids and lipid-like molecules</superklass> <klass>Fatty Acyls</klass> <subklass>Fatty acid esters</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0093244</sync-id> <structure-inchikey>XSDPFNMJFNZEIN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40060000000000000000800000000000000010000000000008000000000040000000001002001000000000004000000100000000000800000000000000000010000000000000000000000000200000000020800010000100000000000000000000000000010000000000000000000000000000000000000000000010000000000000000040000000800000000000000000000000000000000000001000800000000000000400000000000000080000000000000000000000000000000000000000800001000000000000000000000000000000000000000000000200800000000000000000000000000040000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������(�������(�������(�������`�������`������@(������@h�������@h�������@h�������@(��������������������(��� ������� � h� �h���h�� h� h�B����� �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:40:35Z</structure-indexed-at> </compound>