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2.5-Dimethyl-furan
ScientificNameLabel
2.5-Dimethyl-furan
PHCD compound ID :
4011
Chemical Names :
2.5-Dimethyl-furan
Molecular Formula :
C6H8O1
Molecular Weight :
96.057515
More Details :
Names & Synonyms:
2,5-dimethylfuran
Smiles:
Cc1ccc(o1)C
InChi :
InChI=1S/C6H8O/c1-5-3-4-6(2)7-5/h3-4H,1-2H3
InChi Key :
InChIKey=GSNUFIFRDBKVIE-UHFFFAOYSA-N
PubChem ID :
12266
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
8.767968
Hydrogen bond donor count :
0
Electric dipole moment :
0.777
XLogP :
1.181
VDW volume :
92.593217
Molecular weight :
96.057515
HOMO-LUMO gap :
9.571000
Herb list :
Hazel, Filbert - Corylus avellana - فندق
Refrences & Litretures:
552. Journal:'Radiation Physics and Chemistry' Year:'2009' Volume:'78' Page:'407' DOI:'10.1016/j.radphyschem.2009.03.008' Title:'Effect of ?-irradiation on the physicochemical and sensory properties of hazelnuts (Corylus avellana L.)'
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