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ScientificNameLabel
1,6,octaden-1-ol
PHCD compound ID : 1872
Chemical Names :
1,6,octaden-1-ol
Molecular Formula : C8H14O1
Molecular Weight : 126.104465
More Details :
Names & Synonyms:
Smiles: C/C=C/CCC/C=C/O
InChi : InChI=1S/C8H14O/c1-2-3-4-5-6-7-8-9/h2-3,7-9H,4-6H2,1H3/b3-2+,8-7+
InChi Key : InChIKey=JIODGGJJYZJMHR-BSMXIPCLSA-N
PubChem ID :
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.144634
Hydrogen bond donor count : 1 Electric dipole moment : 1.898
XLogP : 3.145 VDW volume : 150.441645
Molecular weight : 126.104465 HOMO-LUMO gap : 10.376000
Herb list :
Refrences & Litretures:
  
220.      Journal:'Journal of Medicinal Plants Research'      Year:'2012'      Volume:'6'      Page:'4522'      DOI:'10.5897/JMPR11.933'      Title:'Essential oil content and composition of Mentha longifolia (L.) Hudson grown wild in Iran'
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