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2.3.5-Trimethyl-furan
ScientificNameLabel
2.3.5-Trimethyl-furan
PHCD compound ID :
4013
Chemical Names :
2.3.5-Trimethyl-furan
Molecular Formula :
C7H10O1
Molecular Weight :
110.073165
More Details :
Names & Synonyms:
2,3,5-trimethylfuran
Smiles:
Cc1oc(c(c1)C)C
InChi :
InChI=1S/C7H10O/c1-5-4-6(2)8-7(5)3/h4H,1-3H3
InChi Key :
InChIKey=NJXZFRUNHWKHEC-UHFFFAOYSA-N
PubChem ID :
517859
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
8.559810
Hydrogen bond donor count :
0
Electric dipole moment :
0.303
XLogP :
1.362
VDW volume :
109.889202
Molecular weight :
110.073165
HOMO-LUMO gap :
9.445000
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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