6549 <common-name>3,7-DIMETHYL-6-OCTENOIC ACID</common-name> <description>3,7-DIMETHYL-6-OCTENOIC ACID belongs to the monoterpenoids, a subclass of prenol lipids within the organic compounds. This compound has the chemical formula C10H18O2 and an average molecular weight of 170.25 g/mol. In industrial applications, the compound serves several roles and uses, functioning as a biocide, deodorizer, and anti-dandruff agent. It is also utilized as a fragrance and as a flavouring and nutrient. The substance is found in or released from 21 recorded sources across various categories. Within household cleaning and consumer products, it is associated with bleaching agents, perfumes within detergents and soaps, cigar cigarettes, other smoking requisites, and non electric simulated smoking devices, among six additional sources. In the sector of electrical and electronic equipment, it is found in electrodes, hybrid capacitors, magnets, conductors or conductive bodies characterised by the conductive materials, and electrically stimulated smoking devices, as well as two other sources. Furthermore, it is present in food, food processing, and cookware, specifically in the preparation of wine or sparkling wine, food preservation, and fermentation processes for beer.</description> <cas>502-47-6</cas> <pubchem-id>10402</pubchem-id> <chemical-formula>C10H18O2</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">2016-05-19T02:02:16Z</created-at> <updated-at type="dateTime">2026-03-31T21:39:08Z</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(CCC=C(C)C)CC(O)=O</moldb-smiles> <moldb-formula>C10H18O2</moldb-formula> <moldb-inchi>InChI=1S/C10H18O2/c1-8(2)5-4-6-9(3)7-10(11)12/h5,9H,4,6-7H2,1-3H3,(H,11,12)</moldb-inchi> <moldb-inchikey>GJWSUKYXUMVMGX-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">170.2487</moldb-average-mass> <moldb-mono-mass type="decimal">170.13067982</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp nil="true"/> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>9973</chemspider-id> <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>CHEM005444</chemdb-id> <dsstox-id>DTXSID1047106</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00012108</susdat-id> <iupac nil="true"/> <moldb-polar-surface-area>37.3</moldb-polar-surface-area> <moldb-refractivity>50.22280000000001</moldb-refractivity> <moldb-polarizability>20.129509141855323</moldb-polarizability> <moldb-rotatable-bond-count>5</moldb-rotatable-bond-count> <moldb-acceptor-count>2</moldb-acceptor-count> <moldb-donor-count>1</moldb-donor-count> <moldb-pka-strongest-acidic>5.189657325457579</moldb-pka-strongest-acidic> <moldb-pka-strongest-basic nil="true"/> <moldb-physiological-charge>-1</moldb-physiological-charge> <moldb-number-of-rings>0</moldb-number-of-rings> <moldb-alogps-logp>2.88</moldb-alogps-logp> <moldb-alogps-logs>-1.99</moldb-alogps-logs> <moldb-alogps-solubility>1.74e+00 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Lipids and lipid-like molecules</superklass> <klass>Prenol lipids</klass> <subklass>Monoterpenoids</subklass> <paper-count type="integer">3</paper-count> <sync-id>CED0015571</sync-id> <structure-inchikey>GJWSUKYXUMVMGX-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000000000000000000000000000000000000001000000000000000000000000004004000000000000000000100000000000000000008000000000100000000000020000000000200000000001000010000000000010000000000000000040000000000000000000000000000000000400000000040000000000000000000040000000000000000000000000000400000002000000000000000000000000000000000000000000000000000000000000000010000020200000000000000000000000000000000000000400000000000000000000000000000000000000000000400000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>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</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAMAAAACwAAAIABBgBgAAAAAQMGAGAAAAAD AQYAYAAAAAICBgBgAAAAAgIGAGgAAAADAwEGACgAAAADBAYAYAAAAAEDBgBg AAAAAQMGAGAAAAACAgYAKAAAAAMECABoAAAAAwEBCAAoAAAAAwILAAEAAQIA AgMAAwQABAUIAgUGAAUHAAEIAAgJAAkKIAkLKAJCAAAAABcEAAAAAAAAABY= </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:02:24Z</structure-indexed-at> </compound>