287850 <common-name>5-(4-chlorophenyl)-3-(3-hydroxypropylamino)oxolan-2-one</common-name> <description>5-(4-chlorophenyl)-3-(3-hydroxypropylamino)oxolan-2-one belongs to the amino acids, peptides, and analogues, a subclass of carboxylic acids and derivatives within the organic compounds. It has the chemical formula C13H16ClNO3 and an average molecular weight of 269.72 g/mol.</description> <cas nil="true"/> <pubchem-id>3071827</pubchem-id> <chemical-formula>C13H16ClNO3</chemical-formula> <weight>269.72</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">2026-08-28T00:31:03Z</created-at> <updated-at type="dateTime">2026-08-28T00:31:03Z</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>C1C(C(=O)OC1C2=CC=C(C=C2)Cl)NCCCO</moldb-smiles> <moldb-formula>C13H16ClNO3</moldb-formula> <moldb-inchi>InChI=1S/C13H16ClNO3/c14-10-4-2-9(3-5-10)12-8-11(13(17)18-12)15-6-1-7-16/h2-5,11-12,15-16H,1,6-8H2</moldb-inchi> <moldb-inchikey>MDPZPGXKEAYRQK-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">269.0818711</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>2.3</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>CHEM283743</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>5-(4-chlorophenyl)-3-(3-hydroxypropylamino)oxolan-2-one</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>Organic acids and derivatives</superklass> <klass>Carboxylic acids and derivatives</klass> <subklass>Amino acids, peptides, and analogues</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0239620</sync-id> <structure-inchikey>MDPZPGXKEAYRQK-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000100000000000000000000000000082000000000000000000000060000000000000000000000000000000000000004000000000000000000000400000000000000000000020801000000000000000000002000000000000010080000000800000000000000000020024000000000000000000100000000000020002000000000020000880000000000000000000000000000011000800000000000000000000080000000004000000000000000000000000000000000000400000000000000000000000000010000000000000000200000000000010000000000000000040000000010000000100000000000000800000001000</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�B������������� ������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:01:05Z</structure-indexed-at> </compound>