6383 <common-name>DECANAL DIMETHYL ACETAL</common-name> <description>DECANAL DIMETHYL ACETAL is an organic compound with the chemical formula C12H26O2 and an average molecular weight of 202.33 g/mol. DECANAL DIMETHYL ACETAL belongs to the ethers, a subclass of organooxygen compounds within the organic compounds. Industrially, the compound is utilized as a fragrance, as well as a flavouring and nutrient. It has been identified in five recorded sources, including food contact materials used in food, food processing, and cookware. It is also found in household cleaning and consumer products, specifically tobacco smoke filters and cigar cigarettes, and in electrical and electronic equipment such as emergency protective devices and electric switches. Recorded exposure routes for this substance include touch, oral, and inhalation.</description> <cas>7779-41-1</cas> <pubchem-id>24513</pubchem-id> <chemical-formula>C12H26O2</chemical-formula> <weight>202.33</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">2016-05-19T02:00:03Z</created-at> <updated-at type="dateTime">2026-08-18T21:03:54Z</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>CCCCCCCCCC(OC)OC</moldb-smiles> <moldb-formula>C12H26O2</moldb-formula> <moldb-inchi>InChI=1S/C12H26O2/c1-4-5-6-7-8-9-10-11-12(13-2)14-3/h12H,4-11H2,1-3H3</moldb-inchi> <moldb-inchikey>NCRNCSZWOOYBQF-UHFFFAOYSA-N</moldb-inchikey> <moldb-average-mass type="decimal">202.3336</moldb-average-mass> <moldb-mono-mass type="decimal">202.193280076</moldb-mono-mass> <origin nil="true"/> <state nil="true"/> <logp>4.6</logp> <hmdb-id nil="true"/> <chembl-id nil="true"/> <chemspider-id>22921</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>CHEM005278</chemdb-id> <dsstox-id>DTXSID3064803</dsstox-id> <toxcast-id nil="true"/> <stoff-ident-origin nil="true"/> <stoff-ident-id nil="true"/> <susdat-id>NS00012191</susdat-id> <iupac>1,1-dimethoxydecane</iupac> <moldb-polar-surface-area>18.46</moldb-polar-surface-area> <moldb-refractivity>60.3836</moldb-refractivity> <moldb-polarizability>26.235766663276735</moldb-polarizability> <moldb-rotatable-bond-count>10</moldb-rotatable-bond-count> <moldb-acceptor-count>2</moldb-acceptor-count> <moldb-donor-count>0</moldb-donor-count> <moldb-pka-strongest-acidic nil="true"/> <moldb-pka-strongest-basic>-3.993946512514199</moldb-pka-strongest-basic> <moldb-physiological-charge>0</moldb-physiological-charge> <moldb-number-of-rings>0</moldb-number-of-rings> <moldb-alogps-logp>4.10</moldb-alogps-logp> <moldb-alogps-logs>-4.41</moldb-alogps-logs> <moldb-alogps-solubility>7.93e-03 g/l</moldb-alogps-solubility> <kingdom>Organic compounds</kingdom> <superklass>Organic oxygen compounds</superklass> <klass>Organooxygen compounds</klass> <subklass>Ethers</subklass> <paper-count type="integer">2</paper-count> <sync-id>CED0021055</sync-id> <structure-inchikey>NCRNCSZWOOYBQF-UHFFFAOYSA-N</structure-inchikey> <structure-fingerprint>40000000000000000000800000000000000000000020000000008000000000000000000002000000000000000000000000000000000000000000000000000000000000000000000000010000080000000000000000000100000000001000000000000020000000000040000000000000000000000000000000000000000010000000000040000000000000000000010000000000000000000000000000000000100000000000000001000000000000000000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000010000000000000000000000000000000000</structure-fingerprint> <structure-pattern-fingerprint>10000000020200000000100100200000000000000500000000004002000004400000000080000000000100000000000420000000041000000044700020000084110000000000000080101000420000000000004000000200000420000001000c2000000000020000000000402000002000001000002000110800000010000200400000044000080800000009080000100400024400000000080800000000000041000000004000000008000004200002c0000000010800000000000000020000000004040000000080000000000200000000000000400000000000080000000000080000000000000000000000200000000010004000000000000050000000</structure-pattern-fingerprint> <structure-pickle type="binary" encoding="base64">776t3gAAAAAQAAAAAwAAAAAAAAAOAAAADQAAAIABBgBgAAAAAQMGAGAAAAAC AgYAYAAAAAICBgBgAAAAAgIGAGAAAAACAgYAYAAAAAICBgBgAAAAAgIGAGAA AAACAgYAYAAAAAICBgBgAAAAAwEIACAAAAACBgBgAAAAAQMIACAAAAACBgBg AAAAAQMLAAEAAQIAAgMAAwQABAUABQYABgcABwgACAkACQoACgsACQwADA0A QgAAAAAXBAAAAAAAAAAW </structure-pickle> <structure-indexed-at type="dateTime">2026-09-19T04:02:18Z</structure-indexed-at> </compound>