315088 <common-name>2-[4-(diethylamino)but-2-ynyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol</common-name> <description>2-[4-(diethylamino)but-2-ynyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol is a chemical compound with the formula C18H31NO. It has an average molecular weight of 277.40 g/mol.</description> <cas>49832-45-3</cas> <pubchem-id>39547</pubchem-id> <chemical-formula>C18H31NO</chemical-formula> <weight>277.4</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">2026-08-29T12:19:43Z</created-at> <updated-at type="dateTime">2026-08-29T12:19:43Z</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>CCN(CC)CC#CCC1(CC2CCC1(C2(C)C)C)O</moldb-smiles> <moldb-formula>C18H31NO</moldb-formula> <moldb-inchi>InChI=1S/C18H31NO/c1-6-19(7-2)13-9-8-11-18(20)14-15-10-12-17(18,5)16(15,3)4/h15,20H,6-7,10-14H2,1-5H3</moldb-inchi> <moldb-inchikey>BEUILPZTNBTKFM-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal" nil="true"/> <moldb-mono-mass type="decimal">277.2405646</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>3.6</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>CHEM310981</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>2-[4-(diethylamino)but-2-ynyl]-1,7,7-trimethylbicyclo[2.2.1]heptan-2-ol</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>CED0265964</sync-id> <structure-inchikey>BEUILPZTNBTKFM-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>100000000000000000800000000000000001000000008000000000800000100000000002000000000000000000000000000000000000000000000000000000000080020000000000400000000000000000000021000000000000000000000800000000010000000000000000004000000000020800000000200000000000100000000048000000000000000000000020200000000000000000000000200020000000000404000000000008000000000000400000000000000000000000000000000000000000000000000000000004000000000800000000000000000200000800008000000000000000000000000000000000000000040000000020000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAUAAAAFQAAAIABBgBgAAAAAQMGAGAAAAAC AgcAIAAAAAMGAGAAAAACAgYAYAAAAAEDBgBgAAAAAgIGACgAAAACBAYAKAAA AAIEBgBgAAAAAgIGACAAAAAEBgBgAAAAAgIGAGAAAAADAQYAYAAAAAICBgBg AAAAAgIGACAAAAAEBgAgAAAABAYAYAAAAAEDBgBgAAAAAQMGAGAAAAABAwgA YAAAAAEBCwABAAECAAIDAAMEAAIFAAUGAAYHCAMHCAAICQAJCgAKCwALDAAM DQANDgAODwAPEAAPEQAOEgAJEwAOCQAPCwBCAgAAAAUJCgsPDgUMCw8ODRcE AAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T05:21:24Z</structure-indexed-at> </compound>