363330 <common-name>N,n-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide</common-name> <description>N,n-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide is a chemical compound with the formula C8H15Cl2NO3. It has an average molecular weight of 244.11 g/mol.</description> <cas nil="true"/> <pubchem-id>57417</pubchem-id> <chemical-formula>C8H15Cl2NO3</chemical-formula> <weight>244.11</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">2026-09-01T12:52:38Z</created-at> <updated-at type="dateTime">2026-09-01T12:52:38Z</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>CCOC(=O)C[N+](CCCl)(CCCl)[O-]</moldb-smiles> <moldb-formula>C8H15Cl2NO3</moldb-formula> <moldb-inchi>InChI=1S/C8H15Cl2NO3/c1-2-14-8(12)7-11(13,5-3-9)6-4-10/h2-7H2,1H3</moldb-inchi> <moldb-inchikey>AKHKNMQNBYNKAP-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">243.0428987</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.2</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>CHEM359223</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>N,n-bis(2-chloroethyl)-2-ethoxy-2-oxoethanamine oxide</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 acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0313367</sync-id> <structure-inchikey>AKHKNMQNBYNKAP-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000200010000000000000000000000000400000000002000000000000000000000000200002000000000000000000000000000000000000001000000000000000000020000000000100001000000000000000000000010000000000000000000000000040000000000000000000000000000000000040000000000004000000000000000000000000000000020000000000000000000000000000000004002000200000000000008000000000000000000000000000020000000000000000000000000010080000002000000000000000000000000000000000000000000000000400000000000000000000000000004000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAOAAAADQAAAIABBgBgAAAAAQMGAGAAAAAC AggAKAAAAAMCBgAoAAAAAwQIACgAAAADAgYAYAAAAAICByAiAAAAAQQGAGAA AAACAgYAYAAAAAICEQAgAAAAAQYAYAAAAAICBgBgAAAAAgIRACAAAAABCCAi AAAA/wELAAEAAQIAAgMgAwQoAgMFAAUGAAYHAAcIAAgJAAYKAAoLAAsMAAYN AEIAAAAAFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T06:00:03Z</structure-indexed-at> </compound>