286906 <common-name>1-thiophen-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine</common-name> <description>1-thiophen-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine belongs to the phenethylamines, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C13H12F3NS and an average molecular weight of 271.30 g/mol.</description> <cas nil="true"/> <pubchem-id>3062025</pubchem-id> <chemical-formula>C13H12F3NS</chemical-formula> <weight>271.3</weight> <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">2026-08-27T23:12:55Z</created-at> <updated-at type="dateTime">2026-08-27T23:12:55Z</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>C1=CC(=CC(=C1)C(F)(F)F)CC(C2=CC=CS2)N</moldb-smiles> <moldb-formula>C13H12F3NS</moldb-formula> <moldb-inchi>InChI=1S/C13H12F3NS/c14-13(15,16)10-4-1-3-9(7-10)8-11(17)12-5-2-6-18-12/h1-7,11H,8,17H2</moldb-inchi> <moldb-inchikey>HTKVAVOGQWDZHG-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">271.0642551</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.4</logp> <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>CHEM282799</chemdb-id> <dsstox-id nil="true"/> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id nil="true"/> <iupac>1-thiophen-2-yl-2-[3-(trifluoromethyl)phenyl]ethanamine</iupac> <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>Benzenoids</superklass> <klass>Benzene and substituted derivatives</klass> <subklass>Phenethylamines</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0238694</sync-id> <structure-inchikey>HTKVAVOGQWDZHG-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40020000000000000001800000002000000000000000000000000000000040000000000100000000000000000000000100020000000000000010000000000000000000010000000000000000000000000000000010000000000000000000000000002000004000000100000000100000000000000000000000000000000000000041000000200000800000000000000000001000000000000000000000080200000000000000000000000080080000000040000000040000000000000000200000000001000000000000000000000000000000000000000000000220000000000000000000000000000040000000000000800000000000000200000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAASAAAAEwAAAIABBkBoAAAAAwMBBkBoAAAA AwMBBkAoAAAAAwQGQGgAAAADAwEGQCgAAAADBAZAaAAAAAMDAQYAIAAAAAQJ ACAAAAABCQAgAAAAAQkAIAAAAAEGAGAAAAACAgYAYAAAAAMBBkAoAAAAAwQG QGgAAAADAwEGQGgAAAADAwEGQGgAAAADAwEQQCgAAAADAgcAYAAAAAECCwAB aAwBAmgMAgNoDAMEaAwEBWgMBAYABgcABggABgkAAgoACgsACwwADA1oDA0O aAwOD2gMDxBoDAsRAAUAaAwQDGgMQgIAAAAGAAUEAwIBBQ0MEA8OFwQAAAAA AAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:00:25Z</structure-indexed-at> </compound>