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1,3,6 octatriene
PHCD compound ID : 1271
Chemical Names :
1,3,6 octatriene , 1,3,6-octatriene
Molecular Formula : C8H12
Molecular Weight : 108.0939
More Details :
Names & Synonyms: (3E,6E)-octa-1,3,6-triene
Smiles: C/C=C/C/C=C/C=C
InChi : InChI=1S/C8H12/c1-3-5-7-8-6-4-2/h3-7H,1,8H2,2H3/b6-4+,7-5+
InChi Key : InChIKey=PKHBEGZTQNOZLP-YDFGWWAZSA-N
PubChem ID : 5367382
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 9.226514
Hydrogen bond donor count : 0 Electric dipole moment : 0.809
XLogP : 3.86 VDW volume : 139.01496
Molecular weight : 108.0939 HOMO-LUMO gap : 9.442000
Herb list :
Refrences & Litretures:
  
134.      Journal:'Asian J. Chem'      Year:'2012'      Volume:'24'      Page:'4817'      DOI:''      Title:'Study of the Essential Oil Composition of Lallemantia iberica (M. Bieb.) Fisch. and C.A. Mey. (Lamiaceae) from Turkey'
435.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2016'      Volume:'19'      Page:'125'      DOI:'10.1080/0972060X.2014.971067'      Title:'In vitro Study to Evaluate the Antibacterial Effect of Pistacia khinjuk Stocks Oil as Compared with Olive Oil on Food Borne Pathogenic Bacteria (Staphylococcus aureus, Escherichia coli, Listeria monocytogenes)'
437.      Journal:'Electronic Journal of Biology'      Year:'2011'      Volume:'7'      Page:'67'      DOI:''      Title:'Chemical Composition of Essential Oil of Pistacia khinjuk Stocks Grown in Bakhtiari Zagross Mountains, Iran'
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