289358 <common-name>N-[[2-chloro-4-(2-methylbutan-2-yl)phenoxy]-methoxyphosphoryl]methanamine</common-name> <description>N-[[2-chloro-4-(2-methylbutan-2-yl)phenoxy]-methoxyphosphoryl]methanamine belongs to the phenylpropanes, a subclass of benzene and substituted derivatives within the organic compounds. It is a benzenoid with the formula C13H21ClNO3P and an average molecular weight of 305.74 g/mol.</description> <cas>4492-96-0</cas> <pubchem-id>78244</pubchem-id> <chemical-formula>C13H21ClNO3P</chemical-formula> <weight>305.74</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">2026-08-28T02:49:01Z</created-at> <updated-at type="dateTime">2026-08-28T02:49:01Z</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>CCC(C)(C)C1=CC(=C(C=C1)OP(=O)(NC)OC)Cl</moldb-smiles> <moldb-formula>C13H21ClNO3P</moldb-formula> <moldb-inchi>InChI=1S/C13H21ClNO3P/c1-6-13(2,3)10-7-8-12(11(14)9-10)18-19(16,15-4)17-5/h7-9H,6H2,1-5H3,(H,15,16)</moldb-inchi> <moldb-inchikey>QSXWTGFXQDSZDO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">305.0947582</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4</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>CHEM285251</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-[[2-chloro-4-(2-methylbutan-2-yl)phenoxy]-methoxyphosphoryl]methanamine</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>Phenylpropanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0241051</sync-id> <structure-inchikey>QSXWTGFXQDSZDO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000800200002000000000000000000080000000000000000000000003000000000000000002001000800000000000000000000002000000200000000800400000000040000020000020000000020180000000000000000000001000000000000040000000100000000000000000000000000000000000000000000040000000000002000000000080000000000000000000008000000000000000000000000000000000080000000040020000000000000000000000000000000000000000200000000000000000400010000000000000000200000000000000000000000000400040010000000000000040000020000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAATAAAAEwAAAIABBgBgAAAAAQMGAGAAAAAC AgYAIAAAAAQGAGAAAAABAwYAYAAAAAEDBkAoAAAAAwQGQGgAAAADAwEGQCgA AAADBAZAKAAAAAMEBkBoAAAAAwMBBkBoAAAAAwMBCAAoAAAAAwIPACAAAAAF CAAoAAAAAwIHAGAAAAACAQYAYAAAAAEDCAAgAAAAAgYAYAAAAAEDEQAgAAAA AQsAAQABAgACAwACBAACBQAFBmgMBgdoDAcIaAwICWgMCQpoDAgLIAsMAAwN CAIMDgAODwAMEAAQEQAHEgAKBWgMQgEAAAAGBQoJCAcGFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:02:16Z</structure-indexed-at> </compound>