93734 <common-name>1,1',1''-[Methylidynetris(oxy)]tris(tridecane)</common-name> <description>1,1',1''-[Methylidynetris(oxy)]tris(tridecane) belongs to the ortho esters, a subclass of organooxygen compounds within the organic compounds. It has the chemical formula C40H82O3. With an average molecular weight of 611.09 g/mol, 1,1',1''-[Methylidynetris(oxy)]tris(tridecane) is a heavy molecule. This compound is further classified as an organic oxygen compound.</description> <cas>59719-97-0</cas> <pubchem-id>108815</pubchem-id> <chemical-formula>C40H82O3</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">2026-04-05T02:17:43Z</created-at> <updated-at type="dateTime">2026-04-05T02:17:43Z</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>CCCCCCCCCCCCCOC(OCCCCCCCCCCCCC)OCCCCCCCCCCCCC</moldb-smiles> <moldb-formula>C40H82O3</moldb-formula> <moldb-inchi>InChI=1/C40H82O3/c1-4-7-10-13-16-19-22-25-28-31-34-37-41-40(42-38-35-32-29-26-23-20-17-14-11-8-5-2)43-39-36-33-30-27-24-21-18-15-12-9-6-3/h40H,4-39H2,1-3H3</moldb-inchi> <moldb-inchikey>JBNCQQVJICVAHS-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">611.093</moldb-average-mass> <moldb-mono-mass type="decimal">610.6263965</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>CHEM089627</chemdb-id> <dsstox-id>DTXSID20975125</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00055377</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>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Ortho esters</subklass> <paper-count type="integer">17</paper-count> <sync-id>CED0030961</sync-id> <structure-inchikey>JBNCQQVJICVAHS-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40040000000000000000800000000000001000000000000000000000000000000000000002000008000000000000000000000000000000000000000000000000000000000001000000010000000000000000000040000100000000000000000000000020000000000000000000000000000000000000000000000000000000000000000040000000000000000000010000000000000000000000000040000000000000000000000000000000000000000000000008000000000000000000000000000000000000000000000000000000000000004000000000000000000000000000000000000000000000000000010000000000000000000000000000000000</structure-fingerprint> 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