100491 <common-name>4,4A,5,6-tetrahydro-7-isopropyl-4,4a-dimethylnaphthalene-2(3H)-one</common-name> <description>4,4A,5,6-tetrahydro-7-isopropyl-4,4a-dimethylnaphthalene-2(3H)-one belongs to the carbonyl compounds, a subclass of organooxygen compounds within the organic compounds. This organic oxygen compound has the formula C15H22O and an average molecular weight of 218.34 g/mol.</description> <cas>93840-79-0</cas> <pubchem-id>5744151</pubchem-id> <chemical-formula>C15H22O</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">2026-04-05T07:52:57Z</created-at> <updated-at type="dateTime">2026-04-05T07:52:57Z</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>CC(C)C1=CC2=CC(=O)CC(C)C2(C)CC1</moldb-smiles> <moldb-formula>C15H22O</moldb-formula> <moldb-inchi>InChI=1/C15H22O/c1-10(2)12-5-6-15(4)11(3)7-14(16)9-13(15)8-12/h8-11H,5-7H2,1-4H3</moldb-inchi> <moldb-inchikey>ZMOKITSGSADCRZ-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">218.34</moldb-average-mass> <moldb-mono-mass type="decimal">218.1670653</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>CHEM096384</chemdb-id> <dsstox-id>DTXSID60917589</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00063553</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>Carbonyl compounds</subklass> <paper-count type="integer">0</paper-count> <sync-id>CED0137232</sync-id> <structure-inchikey>ZMOKITSGSADCRZ-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000088000000000000000000000000000000000010020000000001000000020000000000000000000000000000000000100000000000000000000000000000000000208000000000020002000002000000000000000000000000000000000000000020004000000000000020001000000000000000000100000000048010000000000000100000000200000000000000000000000000020000000040000000000000000080000000000000000000000000000000000000000000000000000000000000000000000000000000000000000200000001000000000000200000000000040080000000000000000000040000000000000200000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAQAAAAEQAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAEDBgAoAAAAAwQGAGgAAAADAwEGACgAAAADBAYAaAAAAAMDAQYA KAAAAAMECAAoAAAAAwIGAGAAAAACAgYAYAAAAAMBBgBgAAAAAQMGACAAAAAE BgBgAAAAAQMGAGAAAAACAgYAYAAAAAICCwABAAECAAEDAAMEKAIEBSAFBigC BgcgBwgoAgcJAAkKAAoLAAoMAAwNAAwOAA4PAA8DAAwFAEICAAAABgMPDgwF BAYGBwkKDAUXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:39:18Z</structure-indexed-at> </compound>