339956 <common-name>1-o-(4,5,6,8,8-pentachlorooctyl) 4-o-(2,4,5-trichlorooctyl) benzene-1,4-dicarboxylate</common-name> <description>1-o-(4,5,6,8,8-pentachlorooctyl) 4-o-(2,4,5-trichlorooctyl) benzene-1,4-dicarboxylate is a chemical compound with the formula C24H30Cl8O4. With an average molecular weight of 666.10 g/mol, 1-o-(4,5,6,8,8-pentachlorooctyl) 4-o-(2,4,5-trichlorooctyl) benzene-1,4-dicarboxylate is a heavy molecule.</description> <cas nil="true"/> <pubchem-id>109432</pubchem-id> <chemical-formula>C24H30Cl8O4</chemical-formula> <weight>666.1</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">2026-08-30T23:22:30Z</created-at> <updated-at type="dateTime">2026-08-30T23:22:30Z</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>CCCC(C(CC(COC(=O)C1=CC=C(C=C1)C(=O)OCCCC(C(C(CC(Cl)Cl)Cl)Cl)Cl)Cl)Cl)Cl</moldb-smiles> <moldb-formula>C24H30Cl8O4</moldb-formula> <moldb-inchi>InChI=1S/C24H30Cl8O4/c1-2-4-17(26)19(28)11-16(25)13-36-24(34)15-8-6-14(7-9-15)23(33)35-10-3-5-18(27)22(32)20(29)12-21(30)31/h6-9,16-22H,2-5,10-13H2,1H3</moldb-inchi> <moldb-inchikey>VYESZYDIRODEBT-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">661.965231</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>9.6</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>CHEM335849</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>1-o-(4,5,6,8,8-pentachlorooctyl) 4-o-(2,4,5-trichlorooctyl) benzene-1,4-dicarboxylate</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>Benzoic acids and derivatives</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0290372</sync-id> <structure-inchikey>VYESZYDIRODEBT-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>400400000200000000008000000002000000500000000000000080000080000000000000020100000000000000004000000000000000800000000000000000000000000000000000000000020000000000200000008001000000000010000000000000200100000000000000000020040000200010200000000000000000000000000000400000000000004000000000000000000000000000000000000000000000100000001000000000000c4000000000000000000000000000000000200000000000000000800000000000000000000010004000000002000300000000000000000080000000000040000000010400000002000000000000000000400000</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">2026-09-19T05:40:19Z</structure-indexed-at> </compound>