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1,3,6-octatriene,3,7-dimethyl
PHCD compound ID : 5419
Chemical Names :
1,3,6-octatriene,3,7-dimethyl
Molecular Formula : C10H16
Molecular Weight : 136.125201
More Details :
Names & Synonyms: 3,7-dimethylocta-1,3,6-triene
Smiles: C=CC(=CCC=C(C)C)C
InChi : InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7-8H,1,6H2,2-4H3
InChi Key : InChIKey=IHPKGUQCSIINRJ-UHFFFAOYSA-N
PubChem ID : 18756
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.960449
Hydrogen bond donor count : 0 Electric dipole moment : 0.911
XLogP : 4.314 VDW volume : 173.606929
Molecular weight : 136.125201 HOMO-LUMO gap : 9.301000
Herb list :
Refrences & Litretures:
  
897.      Journal:'Journal of Medicinal Plants and By-products'      Year:'2016'      Volume:'2'      Page:'159'      DOI:''      Title:'Essential Oils of Salvia hydrangea DC. ex Benth. from Kiasar-Hezarjarib regions, Iran-Impact of eEnvironmental Factors as Quality Determinants'
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