289379 <common-name>[3-[ethyl(methyl)carbamoyl]oxyphenyl]-trimethylazanium</common-name> <description>[3-[ethyl(methyl)carbamoyl]oxyphenyl]-trimethylazanium belongs to the phenoxy compounds, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C13H21N2O2+ and an average molecular weight of 237.32 g/mol.</description> <cas nil="true"/> <pubchem-id>47014</pubchem-id> <chemical-formula>C13H21N2O2+</chemical-formula> <weight>237.32</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">2026-08-28T02:51:11Z</created-at> <updated-at type="dateTime">2026-08-28T02:51:11Z</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>CCN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C</moldb-smiles> <moldb-formula>C13H21N2O2+</moldb-formula> <moldb-inchi>InChI=1S/C13H21N2O2/c1-6-14(2)13(16)17-12-9-7-8-11(10-12)15(3,4)5/h7-10H,6H2,1-5H3/q+1</moldb-inchi> <moldb-inchikey>DECSDBPOXNMWMD-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">237.1603029</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>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>CHEM285272</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-[ethyl(methyl)carbamoyl]oxyphenyl]-trimethylazanium</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>Phenoxy compounds</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0241072</sync-id> <structure-inchikey>DECSDBPOXNMWMD-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000800000000000000000000000000000000000000000002000000200200000000000000000002000000000000000000000000000000000010200000000010000008000030000000000100000000000000000000000000010000000000000000104000000000000800000000000000000000000001008140000000800000200000000000100000001000000800000000010000000020000000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000040000200010000000000000000000000000040000000000400000000000000000000000000000000</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�B�������� �����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:02:17Z</structure-indexed-at> </compound>