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ScientificNameLabel
4-phenyl undecan 4-ol
PHCD compound ID : 1543
Chemical Names :
4-phenyl undecan 4-ol
Molecular Formula : C17H28O1
Molecular Weight : 248.214016
More Details :
Names & Synonyms:
Smiles: CCC[C@](c1ccccc1)(CCCCCCC)O
InChi : InChI=1S/C17H28O/c1-3-5-6-7-11-15-17(18,14-4-2)16-12-9-8-10-13-16/h8-10,12-13,18H,3-7,11,14-15H2,1-2H3/t17-/m1/s1
InChi Key : InChIKey=YLUNSUGVZHPBCO-QGZVFWFLSA-N
PubChem ID :
Rotatable bond count : 9 Rule of five : 1
Hydrogen bond acceptor count : 1 Ionization potential : 9.545493
Hydrogen bond donor count : 1 Electric dipole moment : 1.692
XLogP : 7.416 VDW volume : 280.212589
Molecular weight : 248.214016 HOMO-LUMO gap : 9.765000
Herb list :
Refrences & Litretures:
  
170.      Journal:'J. Crop Prot'      Year:'2012'      Volume:'1'      Page:'313'      DOI:''      Title:'Chemical composition and insecticide activity of lemon verbena essential oil'
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