Skip Navigation Links
ScientificNameLabel
Furan, 2-(2-propenyl)
PHCD compound ID : 5098
Chemical Names :
Furan, 2-(2-propenyl)
Molecular Formula : C7H8O1
Molecular Weight : 108.057515
More Details :
Names & Synonyms: 2-allylfuran , 2-prop-2-enylfuran
Smiles: C=CCc1ccco1
InChi : InChI=1S/C7H8O/c1-2-4-7-5-3-6-8-7/h2-3,5-6H,1,4H2
InChi Key : InChIKey=ZNCOUMAUNDVFCZ-UHFFFAOYSA-N
PubChem ID : 530402
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.197059
Hydrogen bond donor count : 0 Electric dipole moment : 0.602
XLogP : 1.59 VDW volume : 107.252743
Molecular weight : 108.057515 HOMO-LUMO gap : 9.741000
Herb list :
Refrences & Litretures:
  
803.      Journal:'Acta Sci. Pol. Hortorum Cultus'      Year:'2016'      Volume:'15'      Page:'147'      DOI:''      Title:'The chemical composition of the essential oil of leaf celery (Apium graveolens L. var. Secalinum Alef.) under the plants’ irrigation and harvesting method'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
Follow us