95966 <common-name>3-[(4-Fluoro-2-nitrophenyl)amino]propanol</common-name> <description>3-[(4-Fluoro-2-nitrophenyl)amino]propanol belongs to the nitrobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C9H12FN2O3 and an average molecular weight of 214.20 g/mol.</description> <cas>84145-69-7</cas> <pubchem-id>3019732</pubchem-id> <chemical-formula>C9H12FN2O3</chemical-formula> <weight nil="true"/> <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">2026-04-05T03:52:22Z</created-at> <updated-at type="dateTime">2026-04-05T03:52:22Z</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>OCCCNC1=C(C=C(F)C=C1)[N+]([O-])=O</moldb-smiles> <moldb-formula>C9H12FN2O3</moldb-formula> <moldb-inchi>InChI=1/C9H11FN2O3/c10-7-2-3-8(11-4-1-5-13)9(6-7)12(14)15/h2-3,6,11,13H,1,4-5H2</moldb-inchi> <moldb-inchikey>BUEQGTVYXFOTHO-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">214.196</moldb-average-mass> <moldb-mono-mass type="decimal">215.0831955</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM091859</chemdb-id> <dsstox-id>DTXSID20233070</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00058001</susdat-id> <iupac nil="true"/> <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>Nitrobenzenes</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0176555</sync-id> <structure-inchikey>BUEQGTVYXFOTHO-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>801000000000000000000000000000000002000000000000000000000000000000002000000000000000000000000000004000000000000000020000000000000000000000000020001000000010001800000000400000000000010000000200000000100000100000000000000000000000000000000000000000000002000000000020000080000000001000000080000000000000000000000000000000000000080000002080000000000000000100000000000000000200000000000000000000000000020000000000000000000200000000000000000000000000800040000000010000800000001008000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAPAAAADwAAAIABCABgAAAAAQEGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIHAGgAAAADAgEGQCgAAAADBAZAKAAAAAMEBkBo AAAAAwMBBkAoAAAAAwQJACAAAAABBkBoAAAAAwMBBkBoAAAAAwMBByAqAAAA AQMECCAqAAAA/wMBCAAoAAAAAwILAAEAAQIAAgMAAwQABAUgBQZoDAYHaAwH CGgMCAkACApoDAoLaAwGDCAMDSAMDigCCwVoDEIBAAAABgULCggHBhcEAAAA AAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:36:43Z</structure-indexed-at> </compound>