Skip Navigation Links
ScientificNameLabel
Octane
PHCD compound ID : 1772
Chemical Names :
Octane , n-Octane
Molecular Formula : C8H18
Molecular Weight : 114.140851
More Details :
Names & Synonyms: octane , n-octane
Smiles: CCCCCCCC
InChi : InChI=1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3
InChi Key : InChIKey=TVMXDCGIABBOFY-UHFFFAOYSA-N
PubChem ID : 356
Rotatable bond count : 5 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 11.018165
Hydrogen bond donor count : 0 Electric dipole moment : 0.001
XLogP : 4.892 VDW volume : 146.924336
Molecular weight : 114.140851 HOMO-LUMO gap : 14.905000
Herb list :
Refrences & Litretures:
  
198.      Journal:'Anal. Methods'      Year:'2014'      Volume:'6'      Page:'2572'      DOI:'10.1039/c3ay42180e'      Title:'Chemical composition of the essential oils from the hulls of Pistacia vera L. by using magnetic nanoparticle-assisted microwave (MW) distillation: comparison with routine MW and conventional hydrodistillation'
510.      Journal:'Int. J. Biosci'      Year:'2015'      Volume:'6'      Page:'357'      DOI:'10.12692/ijb/6.2.357-365'      Title:'Antibacterial effects and chemical composition of essential oils from Cotoneaster nummularioides pojark and Sonchus arvensis L. leaves extracts on typical food-borne pathogens'
562.      Journal:'chemija'      Year:'2008'      Volume:'19'      Page:'25'      DOI:''      Title:'Volatile constituents from aerial parts and roots of Cichorium intybus L. (chicory) grown in Lithuania'
652.      Journal:'Research Journal of Pharmaceutical, Biological and Chemical Sciences'      Year:'2015'      Volume:'6'      Page:'125'      DOI:''      Title:'Volatile Oil Composition of Carthamus Tinctorius L the Flowers Grown in Kazakhstan'
653.      Journal:'Afr. J. Biotechnol'      Year:'2012'      Volume:'11'      Page:'12921'      DOI:'10.5897/AJB12.1570'      Title:'The essential oil composition of Carthamus tinctorius L. flowers growing in Iran'
678.      Journal:'Molecules'      Year:'2013'      Volume:'18'      Page:'14948'      DOI:'10.3390/molecules181214948'      Title:'Chemical Composition and Biological Activity of Essential Oils of Origanum vulgare L. subsp. vulgare L. under Different Growth Conditions'
764.      Journal:'Research in Pharmaceutical Sciences'      Year:'2012'      Volume:'7'      Page:'51'      DOI:''      Title:'Determination of volatile glucosinolate degradation products in seed coat, stem and in vitro cultures of Moringa peregrina (Forssk.) Fiori'
856.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2018'      Volume:'21'      Page:'1119'      DOI:'10.1080/0972060X.2018.1505555'      Title:'Evaluation of Chemical Composition and Antibacterial Properties of Froriepia subpinnta Essential Oils from Guilan Region: Before and After Flowering'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us