Skip Navigation Links
ScientificNameLabel
1,4-Cineol
PHCD compound ID : 7
Chemical Names :
1,4-Cineol , 1.4-Cineole , 1,4-Cineole , 1,4-epoxy-p-menthane
Molecular Formula : C10H18O1
Molecular Weight : 154.135765
More Details :
Names & Synonyms: 4-isopropyl-1-methyl-7-oxabicyclo[2.2.1]heptane , 1-methyl-4-propan-2-yl-7-oxabicyclo[2.2.1]heptane
Smiles: CC([C@]12CC[C@@](O2)(CC1)C)C
InChi : InChI=1S/C10H18O/c1-8(2)10-6-4-9(3,11-10)5-7-10/h8H,4-7H2,1-3H3/t9-,10+
InChi Key : InChIKey=RFFOTVCVTJUTAD-AOOOYVTPSA-N
PubChem ID : 10106
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.794344
Hydrogen bond donor count : 0 Electric dipole moment : 1.435
XLogP : 2.595 VDW volume : 165.593614
Molecular weight : 154.135765 HOMO-LUMO gap : 12.532000
Herb list :
Refrences & Litretures:
  
1.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2010'      Volume:'13'      Page:'25'      DOI:'10.1080/0972060X.2010.10643787'      Title:'Chemical and Antimicrobial Studies of Juniperus Sabina L. and Juniperus foetidissima Willd. Essential Oils'
9.      Journal:'Food Chemistry'      Year:'2009'      Volume:'112'      Page:'1072'      DOI:'10.1016/j.foodchem.2008.07.015'      Title:'Flavour compounds of Lavandula angustifolia L. to use in food manufacturing: Comparison of three different extraction methods'
58.      Journal:'Food Chemistry'      Year:'2005'      Volume:'91'      Page:'639'      DOI:'10.1016/j.foodchem.2004.06.033'      Title:'Comparison of essential oils compositions of Ferula assa-foetida obtained by supercritical carbon dioxide extraction and hydrodistillation methods'
649.      Journal:'Journal of Essential Oil Research'      Year:'2004'      Volume:'16'      Page:'296'      DOI:'10.1080/10412905.2004.9698725'      Title:'Analysis of the Oil of Heracleum persicum L. (Seeds and Stems)'
715.      Journal:'Z Naturforsch C'      Year:'2005'      Volume:'60'      Page:'369'      DOI:''      Title:'Chemical Composition of Hips Essential Oils of Some Rosa L. Species'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us