333160 <common-name>Trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium</common-name> <description>Trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium is a chemical compound with the formula C22H30NO+. It has an average molecular weight of 324.50 g/mol.</description> <cas nil="true"/> <pubchem-id>44685</pubchem-id> <chemical-formula>C22H30NO+</chemical-formula> <weight>324.5</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">2026-08-30T14:25:53Z</created-at> <updated-at type="dateTime">2026-08-30T14:25:53Z</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(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[N+](C)(C)C</moldb-smiles> <moldb-formula>C22H30NO+</moldb-formula> <moldb-inchi>InChI=1S/C22H30NO/c1-6-21(24)22(18(2)17-23(3,4)5,19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,18H,6,17H2,1-5H3/q+1</moldb-inchi> <moldb-inchikey>TWOAFDBNJDAODK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">324.2327396</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.4</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>CHEM329053</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>Trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium</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>Diphenylmethanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0283645</sync-id> <structure-inchikey>TWOAFDBNJDAODK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000002000040000000000000000000000000810000000001002000001000002000000000004000002000000000000000000000000000000000000000000000000000008000020000000000000000000000000000000000000010000000000000000000000200000200000000000000800000000000000000040000000800000000000000000000000000100000000000000000000000000000000000000000000480000000040000000000000000000010000000000000000000000002000000000000000000000000000200000000200000000000000000000000000020040000000000400000000000000000000000040000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������(�������(������� �����@(������@h�������@h�������@h�������@h�������@h�������@(������@h�������@h�������@h�������@h�������@h��������`�������`�������`������ "�������`�������`�������`������������������������h���h���h�� h� h������h�� h� �h���h���h���������������������� �h���h�B�������� ��� ��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:35:19Z</structure-indexed-at> </compound>