324409 <common-name>[3-[(dimethylamino)methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] benzoate</common-name> <description>[3-[(dimethylamino)methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] benzoate is a compound with the formula C20H29NO2. It has an average molecular weight of 315.40 g/mol.</description> <cas>13083-68-6</cas> <pubchem-id>121524</pubchem-id> <chemical-formula>C20H29NO2</chemical-formula> <weight>315.4</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">2026-08-30T01:36:12Z</created-at> <updated-at type="dateTime">2026-08-30T01:36:12Z</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>CC1(C2CCC1(C(C2CN(C)C)OC(=O)C3=CC=CC=C3)C)C</moldb-smiles> <moldb-formula>C20H29NO2</moldb-formula> <moldb-inchi>InChI=1S/C20H29NO2/c1-19(2)16-11-12-20(19,3)17(15(16)13-21(4)5)23-18(22)14-9-7-6-8-10-14/h6-10,15-17H,11-13H2,1-5H3</moldb-inchi> <moldb-inchikey>AORWTHWPCIEOFC-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">315.2198292</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.7</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>CHEM320302</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-[(dimethylamino)methyl]-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] benzoate</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>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Monoterpenoids</subklass> <paper-count type="integer" nil="true"/> <sync-id>CED0275064</sync-id> <structure-inchikey>AORWTHWPCIEOFC-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>800000000000100040000000000000000000000000000000000000010000000000008000000004000000000000000000000000000100010040000010000000000002000000000028000000000100000000000000000800000000010000002000000000004000000000020000000000000000000000100000000248080000800000000200000000300000000100000000000000000020400000000004000000000000084000000000000800000000000000000000000100000000000000000000000000000000000000000000000000000200000000000000000000000000000040000000000400000000000000004100000000010100</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAXAAAAGQAAAIABBgBgAAAAAQMGACAAAAAE BgBgAAAAAwEGAGAAAAACAgYAYAAAAAICBgAgAAAABAYAYAAAAAMBBgBgAAAA AwEGAGAAAAACAgcAIAAAAAMGAGAAAAABAwYAYAAAAAEDCAAoAAAAAwIGACgA AAADBAgAKAAAAAMCBkAoAAAAAwQGQGgAAAADAwEGQGgAAAADAwEGQGgAAAAD AwEGQGgAAAADAwEGQGgAAAADAwEGAGAAAAABAwYAYAAAAAEDCwABAAECAAID AAMEAAQFAAUGAAYHAAcIAAgJAAkKAAkLAAYMAAwNIA0OKAINDyAPEGgMEBFo DBESaAwSE2gMExRoDAUVAAEWAAUBAAcCABQPaAxCAwAAAAUBAgMEBQUBAgcG BQYQERITFA8XBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:28:34Z</structure-indexed-at> </compound>