102486 <common-name>1-Methylethane-1,2-diyl bis(5-methylheptanoate)</common-name> <description>1-Methylethane-1,2-diyl bis(5-methylheptanoate) belongs to the fatty acid esters, a subclass of fatty acyls within the organic compounds. It has the formula C19H36O4 and an average molecular weight of 328.49 g/mol. This substance is classified as part of the lipids and lipid-like molecules superclass.</description> <cas nil="true"/> <pubchem-id>53422534</pubchem-id> <chemical-formula>C19H36O4</chemical-formula> <weight nil="true"/> <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">2026-04-05T09:33:54Z</created-at> <updated-at type="dateTime">2026-04-05T09:33:54Z</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>CCC(C)CCC(CC(C)C(CCC(C)CC)C(O)=O)C(O)=O</moldb-smiles> <moldb-formula>C19H36O4</moldb-formula> <moldb-inchi>InChI=1/C19H36O4/c1-6-15(3)10-8-12-18(20)22-14-17(5)23-19(21)13-9-11-16(4)7-2/h15-17H,6-14H2,1-5H3</moldb-inchi> <moldb-inchikey>HUFZYWJLBSVRLJ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">328.493</moldb-average-mass> <moldb-mono-mass type="decimal">328.2613596</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <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>CHEM098379</chemdb-id> <dsstox-id>DTXSID80913861</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00065950</susdat-id> <iupac nil="true"/> <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>Lipids and lipid-like molecules</superklass> <klass>Fatty Acyls</klass> <subklass>Fatty acid esters</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0112173</sync-id> <structure-inchikey>UFNOCRFONXFBKB-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000800000000000000800000000000000000000000000000000000000000000000001002000000000000000000000204000000000000000000000000000000000000000080000000000100000000040020000000800000000000001000000000020000010000000000000000800000000000000000000000000000000000000000000040000000000000000000200000000000000000000000000000100000000000000000000000001000000000000000000000000000000000000000001000800000000000000000400000000000000000000000000000000000000000400000000000000800000004000000000400000000000000000000200000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle>ï¾­Þ������������������������€���`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������`�������(�������h��������(�������(�������h��������(������������������������������� �� � ������ � �� ����� ���� ��(������ ��(�B��������������</structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:40:27Z</structure-indexed-at> </compound>