349830 <common-name>[3-(diethylaminomethyl)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate</common-name> <description>[3-(diethylaminomethyl)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate is a chemical compound with the formula C29H39NO3. It has an average molecular weight of 449.60 g/mol.</description> <cas nil="true"/> <pubchem-id>204909</pubchem-id> <chemical-formula>C29H39NO3</chemical-formula> <weight>449.6</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">2026-08-31T14:34:17Z</created-at> <updated-at type="dateTime">2026-08-31T14:34:17Z</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>CCN(CC)CC1C2CCC(C1OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)(C2(C)C)C</moldb-smiles> <moldb-formula>C29H39NO3</moldb-formula> <moldb-inchi>InChI=1S/C29H39NO3/c1-6-30(7-2)20-23-24-18-19-28(5,27(24,3)4)25(23)33-26(31)29(32,21-14-10-8-11-15-21)22-16-12-9-13-17-22/h8-17,23-25,32H,6-7,18-20H2,1-5H3</moldb-inchi> <moldb-inchikey>QZSIQOJVSZSBHE-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">449.2929941</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>6.3</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>CHEM345723</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>[3-(diethylaminomethyl)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] 2-hydroxy-2,2-diphenylacetate</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>Diphenylmethanes</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0300153</sync-id> <structure-inchikey>QZSIQOJVSZSBHE-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>200800000002000000000000000000000000000000000100000000002000000000000000000000004000000000008000000000000000000010040000010000000000000000040000020000000000110000000000000000800000000010000002000000000004000000000020800000000000000000000100000000248080000800000000a000000002000000001000000000000000000204001000000040000000000000800000000c0000800000000000000000000000100000000000000000000000000000000000000000000000000000200000000400000000000000000000040000000080400000000000000040100000040010100</structure-fingerprint> 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ACAAAAAEBgBgAAAAAQMGAGAAAAABAwYAYAAAAAEDCwABAAECAAIDAAMEAAIF AAUGAAYHAAcIAAgJAAkKAAoLAAsMAAwNIA0OKAINDwAPEAAQEWgMERJoDBIT aAwTFGgMFBVoDA8WABYXaAwXGGgMGBloDBkaaAwaG2gMDxwACh0AHR4AHR8A CiAACwYAHQcAFRBoDBsWaAxCBAAAAAUGBx0KCwUIBx0KCQYREhMUFRAGFxgZ GhsWFwQAAAAAAAAAFg== </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:47:52Z</structure-indexed-at> </compound>