336118 <common-name>3-methylbutyl(triphenyl)phosphanium</common-name> <description>3-methylbutyl(triphenyl)phosphanium is a chemical compound with the formula C23H26P+. It has an average molecular weight of 333.40 g/mol.</description> <cas nil="true"/> <pubchem-id>2759380</pubchem-id> <chemical-formula>C23H26P+</chemical-formula> <weight>333.4</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">2026-08-30T18:26:48Z</created-at> <updated-at type="dateTime">2026-08-30T18:26:48Z</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>CC(C)CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3</moldb-smiles> <moldb-formula>C23H26P+</moldb-formula> <moldb-inchi>InChI=1S/C23H26P/c1-20(2)18-19-24(21-12-6-3-7-13-21,22-14-8-4-9-15-22)23-16-10-5-11-17-23/h3-17,20H,18-19H2,1-2H3/q+1</moldb-inchi> <moldb-inchikey>QKMNVQGPFDVZTK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">333.1772128</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.3</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>CHEM332011</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>3-methylbutyl(triphenyl)phosphanium</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>Phenylphosphines and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0286580</sync-id> <structure-inchikey>QKMNVQGPFDVZTK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000000000000000000000000000000000000001000000000000000000000000004000000000000000000000000000000020000000000000000000000000000000000000000000000000000001000000000000000000000000000000000000000000000000000000000000000000000000000000040040000800000000000000000000000000140000000000000000000000000000000000000000000080000000000000000000000000000000000000000000000000000100000000000000000000000000000000000000200000000000000000000020100080044000000000000000200000000000000000000000000</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���h���h���h������h���h���h���h���h���h���h���h�B������� ��� ����������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:37:38Z</structure-indexed-at> </compound>