299552 <common-name>2-[(4-chlorophenyl)-hydroxymethyl]-1-benzofuran-3-carbonitrile</common-name> <description>2-[(4-chlorophenyl)-hydroxymethyl]-1-benzofuran-3-carbonitrile belongs to the benzofurans, a class of organoheterocyclic compounds within the organic compounds. This compound has the formula C16H10ClNO2 and an average molecular weight of 283.71 g/mol.</description> <cas nil="true"/> <pubchem-id>3088249</pubchem-id> <chemical-formula>C16H10ClNO2</chemical-formula> <weight>283.71</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">2026-08-28T16:09:26Z</created-at> <updated-at type="dateTime">2026-08-28T16:09:26Z</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=C2C(=C1)C(=C(O2)C(C3=CC=C(C=C3)Cl)O)C#N</moldb-smiles> <moldb-formula>C16H10ClNO2</moldb-formula> <moldb-inchi>InChI=1S/C16H10ClNO2/c17-11-7-5-10(6-8-11)15(19)16-13(9-18)12-3-1-2-4-14(12)20-16/h1-8,15,19H</moldb-inchi> <moldb-inchikey>GICXNOKADOQSSN-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">283.0400063</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.5</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>CHEM295445</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>2-[(4-chlorophenyl)-hydroxymethyl]-1-benzofuran-3-carbonitrile</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>Organoheterocyclic compounds</superklass> <klass>Benzofurans</klass> <subklass nil="true"/> <paper-count type="integer" nil="true"/> <sync-id>CED0250854</sync-id> <structure-inchikey>GICXNOKADOQSSN-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000000000000000020000000000000000000480140000000000000000000000000000000200800000000000000000000000000000000000000000000000400000000000000004000000800020000000000000000040000000000200010080000000000000000000000000000000200000000000000000000000000000020000800000000080800000000000000100000000000000000000000000000000000000040400088000000000000000000000000000000004000000000000040000000800000000000000000010000000000000000200000000000000804000000004000040000000000000000000000000000000000000020000</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���h���h���h���h���h�� � � �h���h�� h� �h���h� �� ���� ��(���h���h�� h�B�������������������� �� ����������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:09:52Z</structure-indexed-at> </compound>