293570 <common-name>[4-(2-aminoethyl)phenyl] hexanoate</common-name> <description>[4-(2-aminoethyl)phenyl] hexanoate belongs to the phenol esters, a class of benzenoids within the organic compounds. This compound has the chemical formula C14H21NO2 and an average molecular weight of 235.32 g/mol.</description> <cas nil="true"/> <pubchem-id>3045703</pubchem-id> <chemical-formula>C14H21NO2</chemical-formula> <weight>235.32</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">2026-08-28T08:58:25Z</created-at> <updated-at type="dateTime">2026-08-28T08:58:25Z</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>CCCCCC(=O)OC1=CC=C(C=C1)CCN</moldb-smiles> <moldb-formula>C14H21NO2</moldb-formula> <moldb-inchi>InChI=1S/C14H21NO2/c1-2-3-4-5-14(16)17-13-8-6-12(7-9-13)10-11-15/h6-9H,2-5,10-11,15H2,1H3</moldb-inchi> <moldb-inchikey>IQMRBMCEUQHUJU-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">235.1572289</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.9</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>CHEM289463</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>[4-(2-aminoethyl)phenyl] hexanoate</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>Phenol esters</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0245078</sync-id> <structure-inchikey>IQMRBMCEUQHUJU-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>80000000000000000000000000000000000000000000000000000200020020000000000000000000000000000000000000000000000000000000000000000001000000000000002000000000010000020000000000000000002001000000000000000000000000000000004000000000040000000400000204004000000000000000000000000000900000000000000000100000100000000000000000000000000008200100000000000a000000000000000000000000000008000000000000000000000000000000000000000040000220000000000000000000008000000040000000010400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>2001220e0008000000010820000000000000052000002000400200000440020000008000000000010000800000042000a0008c30010000443000a00000c4110000020002000080102000620100000001004000013240000420000009000c2004040040820000000000543000012000801001056004111800000211000200440008044000080800020088080008111c0002444014820004080000008000004300001000c00000000840017c211002c0000008410840000000000040021000000004040000000180000000010280000000000200400009000000080000000000080000010000000000020002200000100010804000020000000052000002</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������(�������(�������(������@(������@h�������@h�������@(������@h�������@h��������`�������`�������`�����������������������(��� �� � h� h� �h���h�� h���������� �h�B������ �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:05:27Z</structure-indexed-at> </compound>