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ScientificNameLabel
Dihydro-2-methyl-3-furanone
PHCD compound ID : 3027
Chemical Names :
Dihydro-2-methyl-3-furanone , 2-Methyl-3-tetrahydrofuranone
Molecular Formula : C5H8O2
Molecular Weight : 100.052429
More Details :
Names & Synonyms: 2-methyltetrahydrofuran-3-one , 2-methyl-3-oxolanone , 2-methyloxolan-3-one
Smiles: O=C1CCO[C@@H]1C
InChi : InChI=1S/C5H8O2/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3/t4-/m1/s1
InChi Key : InChIKey=FCWYQRVIQDNGBI-SCSAIBSYSA-N
PubChem ID : 18522
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.180140
Hydrogen bond donor count : 0 Electric dipole moment : 1.991
XLogP : -0.187 VDW volume : 97.623918
Molecular weight : 100.052429 HOMO-LUMO gap : 10.726000
Herb list :
Refrences & Litretures:
  
385.      Journal:'Eur J Clin Microbiol Infect Dis'      Year:'2012'      Volume:'31'      Page:'1015'      DOI:'10.1007/s10096-011-1400-1'      Title:'Antistaphylococcal activity of Inula helenium L. root essential oil: eudesmane sesquiterpene lactones induce cell membrane damage'
542.      Journal:'Folia Pomer. Univ. Technol. Stetin., Agric., Aliment., Pisc., Zootech'      Year:'2015'      Volume:'320'      Page:'95'      DOI:''      Title:'GC-MS ANALYSIS OF ESSENTIAL OILS ISOLATED FROM FRUITS OF CHOSEN HOT PEPPER (CAPSICUM ANNUUM L.) CULTIVARS'
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