81871 <common-name>1,1'-(Phenylphosphonoyl)bis(2-methylaziridine)</common-name> <description>1,1'-(Phenylphosphonoyl)bis(2-methylaziridine) belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C12H17N2OP and an average molecular weight of 236.25 g/mol.</description> <cas>57-40-9</cas> <pubchem-id>66134</pubchem-id> <chemical-formula>C12H17N2OP</chemical-formula> <weight>236.25</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">2026-04-04T18:31:46Z</created-at> <updated-at type="dateTime">2026-08-27T20:25:27Z</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>CC1CN1P(=O)(N1CC1C)C1=CC=CC=C1</moldb-smiles> <moldb-formula>C12H17N2OP</moldb-formula> <moldb-inchi>InChI=1/C12H17N2OP/c1-10-8-13(10)16(15,14-9-11(14)2)12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3</moldb-inchi> <moldb-inchikey>YOYMEKJZSAQGNB-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">236.255</moldb-average-mass> <moldb-mono-mass type="decimal">236.1078498</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.8</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>CHEM077764</chemdb-id> <dsstox-id>DTXSID20883231</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00041219</susdat-id> <iupac>2-methyl-1-[(2-methylaziridin-1-yl)-phenylphosphoryl]aziridine</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 nil="true"/> <paper-count type="integer">0</paper-count> <sync-id>CED0169329</sync-id> <structure-inchikey>YOYMEKJZSAQGNB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80001000000000000000000000000000000000002000000004000000000000000000000002000010000000000000000000000000000000000020000000000000000000021000000000000000000040000010000000004000000000020100000000000000000000100000000040000000800000000000000000000000000100000000000000000000000000040000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000200000002000000000000000000000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEgAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAICBwAgAAAAAw8AIAAAAAUIACgAAAADAgcAIAAAAAMGAGAAAAAC AgYAYAAAAAMBBgBgAAAAAQMGQCgAAAADBAZAaAAAAAMDAQZAaAAAAAMDAQZA aAAAAAMDAQZAaAAAAAMDAQZAaAAAAAMDAQsAAQABAgACAwADBAAEBQgCBAYA BgcABwgACAkABAoACgtoDAsMaAwMDWgMDQ5oDA4PaAwDAQAIBgAPCmgMQgMA AAADAQIDAwcGCAYLDA0ODwoXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:28:16Z</structure-indexed-at> </compound>