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ScientificNameLabel
2-methylfuran
PHCD compound ID : 4185
Chemical Names :
2-methylfuran
Molecular Formula : C5H6O1
Molecular Weight : 82.041865
More Details :
Names & Synonyms: 2-methylfuran
Smiles: Cc1ccco1
InChi : InChI=1S/C5H6O/c1-5-3-2-4-6-5/h2-4H,1H3
InChi Key : InChIKey=VQKFNUFAXTZWDK-UHFFFAOYSA-N
PubChem ID : 10797
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.133600
Hydrogen bond donor count : 0 Electric dipole moment : 0.879
XLogP : 0.945 VDW volume : 75.297232
Molecular weight : 82.041865 HOMO-LUMO gap : 9.763000
Herb list :
Refrences & Litretures:
  
589.      Journal:'Food Chemistry'      Year:'2004'      Volume:'84'      Page:'367'      DOI:'10.1016/S0308-8146(03)00241-3'      Title:'Changes in chemical composition of pumpkin seeds during the roasting process for production of pumpkin seed oil (Part 2: volatile compounds)'
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