68729 <common-name>Dimethyl 5-hydroxyisophthalate</common-name> <description nil="true"/> <cas>13036-02-7</cas> <pubchem-id>83065</pubchem-id> <chemical-formula>C10H10O5</chemical-formula> <weight>210.18</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">2026-04-03T13:09:37Z</created-at> <updated-at type="dateTime">2026-08-17T21:46:52Z</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>COC(=O)C1=CC(=CC(O)=C1)C(=O)OC</moldb-smiles> <moldb-formula>C10H10O5</moldb-formula> <moldb-inchi>InChI=1S/C10H10O5/c1-14-9(12)6-3-7(10(13)15-2)5-8(11)4-6/h3-5,11H,1-2H3</moldb-inchi> <moldb-inchikey>DOSDTCPDBPRFHQ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">210.185</moldb-average-mass> <moldb-mono-mass type="decimal">210.052823</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>1.3</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>74937</chemspider-id> <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>CHEM064622</chemdb-id> <dsstox-id>DTXSID8065329</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00024100</susdat-id> <iupac>dimethyl 5-hydroxybenzene-1,3-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">33</paper-count> <sync-id>CED0026203</sync-id> <structure-inchikey>DOSDTCPDBPRFHQ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000100000000000000000000000000000100000000000000000000000000000000000000000000000000000000000000000000000000000000000000000020000000000100000000000040000000000000010000000040000000100000002000000000000000000000000000000000000040000001000000000000000080000000000000000000000000000000000000000001000000000000084000000000000000000000000000000000000000000000000000002000000000000000000000000000100000000000000000000000000000000000000040000000000400000000000000000000000000000000</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">2026-09-19T04:18:37Z</structure-indexed-at> </compound>