96440 <common-name>4-(1-Aminopropyl)phenol</common-name> <description>4-(1-Aminopropyl)phenol belongs to the phenylpropylamines, a subclass of benzene and substituted derivatives within the organic compounds. It is classified as a benzenoid with the chemical formula C9H13NO and an average molecular weight of 151.21 g/mol.</description> <cas>85068-38-8</cas> <pubchem-id>3020319</pubchem-id> <chemical-formula>C9H13NO</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">2026-04-05T04:19:07Z</created-at> <updated-at type="dateTime">2026-04-05T04:19:07Z</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(N)C1=CC=C(O)C=C1</moldb-smiles> <moldb-formula>C9H13NO</moldb-formula> <moldb-inchi>InChI=1/C9H13NO/c1-2-9(10)7-3-5-8(11)6-4-7/h3-6,9,11H,2,10H2,1H3</moldb-inchi> <moldb-inchikey>WTQZYHPAVNTISM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">151.209</moldb-average-mass> <moldb-mono-mass type="decimal">151.099714</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>CHEM092333</chemdb-id> <dsstox-id>DTXSID301005432</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00058550</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>Phenylpropylamines</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0158685</sync-id> <structure-inchikey>WTQZYHPAVNTISM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000000000000000000000000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000040000000000000000000000000000000000000000040000000002000010000000000000000000000000000000000000000800000000000000000000040000000000000000000000000001000000000000000000000000200000000004000000000000400080000000000000000000000000000000000000000800000000000002000000000000000000000000000000000000200001020000000000000000004000040000000000000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`������@(������@h�������@h�������@(�������h�������@h�������@h���������������������h���h���h��� � h� h� �h�B������ �������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:37:02Z</structure-indexed-at> </compound>