292395 <common-name>6-[(4-iodophenyl)methoxycarbonylamino]hexanoic acid</common-name> <description>6-[(4-iodophenyl)methoxycarbonylamino]hexanoic acid belongs to the benzyloxycarbonyls, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C14H18INO4 and an average molecular weight of 391.20 g/mol.</description> <cas nil="true"/> <pubchem-id>50015</pubchem-id> <chemical-formula>C14H18INO4</chemical-formula> <weight>391.2</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">2026-08-28T07:41:18Z</created-at> <updated-at type="dateTime">2026-08-28T07:41:18Z</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>C1=CC(=CC=C1COC(=O)NCCCCCC(=O)O)I</moldb-smiles> <moldb-formula>C14H18INO4</moldb-formula> <moldb-inchi>InChI=1S/C14H18INO4/c15-12-7-5-11(6-8-12)10-20-14(19)16-9-3-1-2-4-13(17)18/h5-8H,1-4,9-10H2,(H,16,19)(H,17,18)</moldb-inchi> <moldb-inchikey>DPQSTRALDMSWEN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">391.02806</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>CHEM288288</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>6-[(4-iodophenyl)methoxycarbonylamino]hexanoic acid</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>Benzyloxycarbonyls</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0243957</sync-id> <structure-inchikey>DPQSTRALDMSWEN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000000010000000000004000000000000000000000000000200000000000000000004000000000000000000000000000100000000000000000000008000000000000020041000000100000000000040000000000000010000000000000000000000000000000000100000000000000000000000000000000000000002000000010080000000000000000000000000021000810000000000000000000000080000000000000000000000000002000000000000000008000000200000000000000000000000000000000000400222000000000000000000000000000048000000012400000000000000000000000008000020</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€��@h�������@h�������@(������@h�������@h�������@(�������`�������(�������(�������(�������h��������`�������`�������`�������`�������`�������(�������(�������h������5� �������h���h���h���h���h��������� � (�� ������ � ����������(��� �����h�B���������������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:04:35Z</structure-indexed-at> </compound>