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3-furanmethanol
ScientificNameLabel
3-furanmethanol
PHCD compound ID :
2192
Chemical Names :
3-furanmethanol
Molecular Formula :
C5H6O2
Molecular Weight :
98.036779
More Details :
Names & Synonyms:
3-furylmethanol , 3-furanylmethanol , furan-3-ylmethanol
Smiles:
OCc1cocc1
InChi :
InChI=1S/C5H6O2/c6-3-5-1-2-7-4-5/h1-2,4,6H,3H2
InChi Key :
InChIKey=STJIISDMSMJQQK-UHFFFAOYSA-N
PubChem ID :
20449
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.580048
Hydrogen bond donor count :
1
Electric dipole moment :
1.762
XLogP :
-0.147
VDW volume :
84.087459
Molecular weight :
98.036779
HOMO-LUMO gap :
9.875000
Herb list :
white mulberry - Morus alba - توت سفید، توت هراتی
Refrences & Litretures:
257. Journal:'J. Agric. Food Chem' Year:'2012' Volume:'60' Page:'9097' DOI:'10.1021/jf301800x' Title:'Antioxidant Activities of Extracts from Teas Prepared from Medicinal Plants, Morus alba L., Camellia sinensis L., and Cudrania tricuspidata, and Their Volatile Components'
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