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ScientificNameLabel
3-hydroxy-4,5-dimethyl-2(5H)-furanone
PHCD compound ID : 3977
Chemical Names :
3-hydroxy-4,5-dimethyl-2(5H)-furanone
Molecular Formula : C6H8O3
Molecular Weight : 128.047344
More Details :
Names & Synonyms: 4-hydroxy-2,3-dimethyl-2H-furan-5-one , 2,3-dimethyl-4-oxidanyl-2H-furan-5-one
Smiles: C[C@H]1OC(=O)C(=C1C)O
InChi : InChI=1S/C6H8O3/c1-3-4(2)9-6(8)5(3)7/h4,7H,1-2H3/t4-/m1/s1
InChi Key : InChIKey=UNYNVICDCJHOPO-SCSAIBSYSA-N
PubChem ID : 62835
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.689441
Hydrogen bond donor count : 1 Electric dipole moment : 3.814
XLogP : 1.033 VDW volume : 121.07367
Molecular weight : 128.047344 HOMO-LUMO gap : 9.331000
Herb list :
Refrences & Litretures:
  
544.      Journal:'International Journal of Food Properties'      Year:'2013'      Volume:'16'      Page:'18'      DOI:'10.1080/10942912.2010.513616'      Title:'Pakistani Bell Pepper (Capsicum annum L.): Chemical Compositions and its Antioxidant Activity'
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