279847 <common-name>Methyl 2-[(4-chlorophenyl)diazenyl]-2-cyanoacetate</common-name> <description>Methyl 2-[(4-chlorophenyl)diazenyl]-2-cyanoacetate belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C10H8ClN3O2 and an average molecular weight of 237.64 g/mol.</description> <cas>60194-81-2</cas> <pubchem-id>43230</pubchem-id> <chemical-formula>C10H8ClN3O2</chemical-formula> <weight>237.64</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">2026-08-26T19:46:41Z</created-at> <updated-at type="dateTime">2026-08-26T19:46:41Z</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>COC(=O)C(C#N)N=NC1=CC=C(C=C1)Cl</moldb-smiles> <moldb-formula>C10H8ClN3O2</moldb-formula> <moldb-inchi>InChI=1S/C10H8ClN3O2/c1-16-10(15)9(6-12)14-13-8-4-2-7(11)3-5-8/h2-5,9H,1H3</moldb-inchi> <moldb-inchikey>KZUCEIVZTJLBSQ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">237.0305042</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.7</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>CHEM275740</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>Methyl 2-[(4-chlorophenyl)diazenyl]-2-cyanoacetate</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>CED0231897</sync-id> <structure-inchikey>KZUCEIVZTJLBSQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000002000000000000000000000010000000000000200080000000000000000000000000000000000000000000000000000000000000000000040000000000010000400000000000000000000020000020000108000004000000000000000200010080000040000000000000000000001000000000000000000000000000000040020000000000000000000080000000000000000000000000000000000000000101000000000040088000000000000000000000000000000000000000000000000100000000000000000000000010000000000000000200400000000000000000000002000040800000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEAAAAIABBgBgAAAAAQMIACgAAAAD AgYAKAAAAAMECAAoAAAAAwIGAGAAAAADAQYAKAAAAAIEBwAoAAAAAgMHACgA AAADAwcAKAAAAAMDBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQCgAAAAD BAZAaAAAAAMDAQZAaAAAAAMDAREAIAAAAAELAAEAAQIgAgMoAgIEAAQFAAUG CAMEBwAHCCgCCAkgCQpoDAoLaAwLDGgMDA1oDA0OaAwMDwAOCWgMQgEAAAAG CQ4NDAsKFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:55:04Z</structure-indexed-at> </compound>