356131 <common-name>6-[dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azanium</common-name> <description>6-[dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azanium is a chemical compound with the formula C42H82N2+2. With an average molecular weight of 615.10 g/mol, 6-[dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azanium is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>51473</pubchem-id> <chemical-formula>C42H82N2+2</chemical-formula> <weight>615.1</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">2026-09-01T01:20:53Z</created-at> <updated-at type="dateTime">2026-09-01T01:20:53Z</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>CC1CCCC2(C1CCC(C)[N+](C)(C)CCCCCC[N+](C)(C)C(C)CCC3C(CCCC34CCCCC4)C)CCCCC2</moldb-smiles> <moldb-formula>C42H82N2+2</moldb-formula> <moldb-inchi>InChI=1S/C42H82N2/c1-35-21-19-31-41(27-13-11-14-28-41)39(35)25-23-37(3)43(5,6)33-17-9-10-18-34-44(7,8)38(4)24-26-40-36(2)22-20-32-42(40)29-15-12-16-30-42/h35-40H,9-34H2,1-8H3/q+2</moldb-inchi> <moldb-inchikey>VCPQSHJNIANSSF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">614.6478006</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>14.2</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>CHEM352024</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>6-[dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]azaniumyl]hexyl-dimethyl-[4-(4-methylspiro[5.5]undecan-5-yl)butan-2-yl]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>Organic nitrogen compounds</superklass> <klass>Organonitrogen compounds</klass> <subklass>Quaternary ammonium salts</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0306381</sync-id> <structure-inchikey>VCPQSHJNIANSSF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>60028000000000000000800000000000200000000000000000000000000000000008001000000000200000000000000000000002000000000000000000000000000000000000000000000000000108000000000000100000000000001000000000000000000000008010000000000000000040020000000000000000000000100800000048000000000000000000010020200000000000008000200000000000000000048004000000000000000000000000000000000000000000000000000000000000000000000000000002100000000000000000000000000000000000000000000000000000100200000000010000000000000000000000000000200080</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ����������������,���/���€���`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`������ "�������`�������`�������`�������`�������`�������`�������`�������`������ "�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������� ������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`������������������������������� � � ������ �������������������������������������������������������� � !�!"�"#�#$�$%��&��'�'(�()�)*�*+����+�� ��% �B���������������� ��!"#$% �'()*+�����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:53:57Z</structure-indexed-at> </compound>