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ScientificNameLabel
2H-Pyran-2-one,5,6-dihydro
PHCD compound ID : 5239
Chemical Names :
2H-Pyran-2-one,5,6-dihydro
Molecular Formula : C5H6O2
Molecular Weight : 98.036779
More Details :
Names & Synonyms: 2,3-dihydropyran-6-one
Smiles: O=C1OCCC=C1
InChi : InChI=1S/C5H6O2/c6-5-3-1-2-4-7-5/h1,3H,2,4H2
InChi Key : InChIKey=QBDAFARLDLCWAT-UHFFFAOYSA-N
PubChem ID : 520660
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.539790
Hydrogen bond donor count : 0 Electric dipole moment : 5.452
XLogP : 0.466 VDW volume : 94.987459
Molecular weight : 98.036779 HOMO-LUMO gap : 10.131000
Herb list :
Refrences & Litretures:
  
836.      Journal:'International Journal of ChemTech Research'      Year:'2010'      Volume:'2'      Page:'149'      DOI:''      Title:'Chemical Constituents of hydro alcoholic extract and Phenolic fraction of Cynodon dactylon'
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