Skip Navigation Links
ScientificNameLabel
1,7-Dioxaspiro[5,5]undec-2-ene
PHCD compound ID : 2976
Chemical Names :
1,7-Dioxaspiro[5,5]undec-2-ene
Molecular Formula : C9H14O2
Molecular Weight : 154.09938
More Details :
Names & Synonyms: 1,7-dioxaspiro[5.5]undec-2-ene
Smiles: C1CC[C@@]2(OC1)CCC=CO2
InChi : InChI=1S/C9H14O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h3,7H,1-2,4-6,8H2/t9-/m0/s1
InChi Key : InChIKey=FZOYTBAOVIOBAN-VIFPVBQESA-N
PubChem ID : 566601
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 8.942714
Hydrogen bond donor count : 0 Electric dipole moment : 1.095
XLogP : 1.957 VDW volume : 154.451398
Molecular weight : 154.09938 HOMO-LUMO gap : 10.345000
Herb list :
Refrences & Litretures:
  
377.      Journal:'Pharmaceutical Biology'      Year:'2011'      Volume:'49'      Page:'756'      DOI:'10.3109/13880209.2010.547206'      Title:'Chemical constituents and bioactivities of the liposoluble fraction from different medicinal parts of Crocus sativus'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us