<?xml version="1.0" encoding="UTF-8"?>
<compound>
  <id type="integer">4821</id>
  <title>T3D4766</title>
  <common-name>N-Decane</common-name>
  <description>N-Decane is found in common oregano. Decane is an alkane hydrocarbon with the chemical formula CH3(CH2)8CH3. 75 isomers of decane exist, all of which are flammable liquids. N-Decane belongs to the family of Acyclic Alkanes. These are acyclic hydrocarbons consisting only of n carbon atoms and m hydrogen atoms where m=2*n + 2.</description>
  <cas>124-18-5</cas>
  <pubchem-id>15600</pubchem-id>
  <chemical-formula>C10H22</chemical-formula>
  <weight>142.28</weight>
  <appearance></appearance>
  <melting-point>-29.7°C</melting-point>
  <boiling-point>174.1°C</boiling-point>
  <density nil="true"/>
  <solubility>0.052 mg/L (at 25°C)</solubility>
  <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>No indication of carcinogenicity to humans (not listed by IARC).</carcinogenicity>
  <use-source>N-Decane is found in common oregano.</use-source>
  <min-risk-level nil="true"/>
  <health-effects nil="true"/>
  <symptoms nil="true"/>
  <treatment nil="true"/>
  <created-at type="dateTime">2014-09-11T05:15:42Z</created-at>
  <updated-at type="dateTime">2026-04-16T22:35:38Z</updated-at>
  <interacting-proteins nil="true"/>
  <wikipedia>http://en.wikipedia.org/wiki/Decane</wikipedia>
  <uniprot-id nil="true"/>
  <kegg-compound-id nil="true"/>
  <omim-id nil="true"/>
  <chebi-id>32894</chebi-id>
  <biocyc-id nil="true"/>
  <ctd-id nil="true"/>
  <stitch-id nil="true"/>
  <drugbank-id>DB02826</drugbank-id>
  <pdb-id>D10</pdb-id>
  <actor-id nil="true"/>
  <organism nil="true"/>
  <export type="boolean">true</export>
  <metabolizing-proteins nil="true"/>
  <transporting-proteins nil="true"/>
  <moldb-smiles>CCCCCCCCCC</moldb-smiles>
  <moldb-formula>C10H22</moldb-formula>
  <moldb-inchi>InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3</moldb-inchi>
  <moldb-inchikey>DIOQZVSQGTUSAI-UHFFFAOYSA-N</moldb-inchikey>
  <moldb-average-mass type="decimal">142.2817</moldb-average-mass>
  <moldb-mono-mass type="decimal">142.172150704</moldb-mono-mass>
  <origin>Exogenous</origin>
  <state>Liquid</state>
  <logp>5.01</logp>
  <hmdb-id>HMDB31450</hmdb-id>
  <chembl-id nil="true"/>
  <chemspider-id>14840</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>&lt;p&gt;Takao Yoshida, &amp;#8220;Methyl substituted oxobicyclo-4,4,0-decane derivatives, process for preparing same and organoleptic uses thereof.&amp;#8221; U.S. Patent US4377714, issued October, 1944.&lt;/p&gt;</synthesis-reference>
  <structure-image-caption nil="true"/>
  <chemdb-id>CHEM003723</chemdb-id>
  <dsstox-id>DTXSID6024913</dsstox-id>
  <toxcast-id nil="true"/>
  <stoff-ident-origin nil="true"/>
  <stoff-ident-id nil="true"/>
  <susdat-id nil="true"/>
  <iupac>decane</iupac>
</compound>
