73263 <common-name>Acetamide, N-(4-butyl-2-nitrophenyl)-</common-name> <description>Acetamide, N-(4-butyl-2-nitrophenyl)- belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C12H16N2O3 and an average molecular weight of 236.27 g/mol.</description> <cas>3663-21-6</cas> <pubchem-id>77228</pubchem-id> <chemical-formula>C12H16N2O3</chemical-formula> <weight>236.27</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">2026-04-03T23:22:48Z</created-at> <updated-at type="dateTime">2026-08-18T18:49:13Z</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>CCCCC1=CC(=C(NC(C)=O)C=C1)[N+]([O-])=O</moldb-smiles> <moldb-formula>C12H16N2O3</moldb-formula> <moldb-inchi>InChI=1S/C12H16N2O3/c1-3-4-5-10-6-7-11(13-9(2)15)12(8-10)14(16)17/h6-8H,3-5H2,1-2H3,(H,13,15)</moldb-inchi> <moldb-inchikey>XXHAVEZHZLGQOE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">236.271</moldb-average-mass> <moldb-mono-mass type="decimal">236.116092</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>69655</chemspider-id> <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>CHEM069156</chemdb-id> <dsstox-id>DTXSID8074601</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00030066</susdat-id> <iupac>N-(4-butyl-2-nitrophenyl)acetamide</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>Anilides</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0093471</sync-id> <structure-inchikey>XXHAVEZHZLGQOE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000800000000000000000000000000000000004000000000002000200000000002000000000000000000000000000000000000000000000020000000000010000000000000020000000000000001800000000400000000020010000000200400000100000000000002000000000012000000000400000000040000000000000000000000080000000001000000080001000000000000000000000000000000000080000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000220000000000000008000000000800040000000010400000000001000000000000000200000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAARAAAAEQAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGQCgAAAADBAZAaAAAAAMDAQZAKAAAAAMEBkAo AAAAAwQHAGgAAAADAgEGACgAAAADBAYAYAAAAAEDCAAoAAAAAwIGQGgAAAAD AwEGQGgAAAADAwEHICoAAAABAwQIICoAAAD/AwEIACgAAAADAgsAAQABAgAC AwADBAAEBWgMBQZoDAYHaAwHCCAICSAJCgAJCygCBwxoDAwNaAwGDiAODyAO ECgCDQRoDEIBAAAABgQNDAcGBRcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:22:01Z</structure-indexed-at> </compound>