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ScientificNameLabel
(Z)-1,5-Octadien-3-ol
PHCD compound ID : 3545
Chemical Names :
(Z)-1,5-Octadien-3-ol
Molecular Formula : C8H14O1
Molecular Weight : 126.104465
More Details :
Names & Synonyms: (5Z)-octa-1,5-dien-3-ol , (5Z)-3-octa-1,5-dienol
Smiles: CC/C=C\C[C@H](C=C)O
InChi : InChI=1S/C8H14O/c1-3-5-6-7-8(9)4-2/h4-6,8-9H,2-3,7H2,1H3/b6-5-/t8-/m0/s1
InChi Key : InChIKey=APFBWMGEGSELQP-SLGIHZDVSA-N
PubChem ID : 6430307
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.688595
Hydrogen bond donor count : 1 Electric dipole moment : 2.287
XLogP : 2.191 VDW volume : 150.441645
Molecular weight : 126.104465 HOMO-LUMO gap : 10.480000
Herb list :
Refrences & Litretures:
  
498.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2010'      Volume:'13'      Page:'313'      DOI:'10.1080/0972060X.2010.10643826'      Title:'Chemical Composition of the Leaves Essential Oil of Melilotus officinalis (L.) Pallas from Colombia'
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