277044 <common-name>2-[[4-(trifluoromethyl)phenyl]methyl]-1h-indole</common-name> <description>2-[[4-(trifluoromethyl)phenyl]methyl]-1h-indole belongs to the trifluoromethylbenzenes, a subclass of benzene and substituted derivatives within the organic compounds. This compound has the chemical formula C32H24F6N2. With an average molecular weight of 550.50 g/mol, 2-[[4-(trifluoromethyl)phenyl]methyl]-1h-indole is a heavy molecule. Regarding its health effects, the compound has a therapeutic effect on inflammation (PMC10135842, PMC8625315).</description> <cas nil="true"/> <pubchem-id>139191468</pubchem-id> <chemical-formula>C32H24F6N2</chemical-formula> <weight>550.5</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">2026-08-26T16:51:42Z</created-at> <updated-at type="dateTime">2026-08-26T16:51:42Z</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=C2C(=C1)C=C(N2)CC3=CC=C(C=C3)C(F)(F)F.C1=CC=C2C(=C1)C=C(N2)CC3=CC=C(C=C3)C(F)(F)F</moldb-smiles> <moldb-formula>C32H24F6N2</moldb-formula> <moldb-inchi>InChI=1S/2C16H12F3N/c2*17-16(18,19)13-7-5-11(6-8-13)9-14-10-12-3-1-2-4-15(12)20-14/h2*1-8,10,20H,9H2</moldb-inchi> <moldb-inchikey>NNXWVRXROOQQNO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">550.1843678</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>CHEM272937</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>2-[[4-(trifluoromethyl)phenyl]methyl]-1h-indole</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>Trifluoromethylbenzenes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0229228</sync-id> <structure-inchikey>NNXWVRXROOQQNO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>20000000000000800000002100000000000000000000000000000000000000000000000200000000000000000100400000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000004000000000004000100008000000000000004000000000001000000000000001000001800000200000000000000000000100000000000000080000000000000000000000000000080000000040020000040000000000000000000000000000000000000000000000000000400000000000000000004220000001000000004000000001000040000000000000800000000000000000000000000000</structure-fingerprint> 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