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ScientificNameLabel
1-Hydroxy-2-Propanone
PHCD compound ID : 565
Chemical Names :
1-Hydroxy-2-Propanone
Molecular Formula : C3H6O2
Molecular Weight : 74.036779
More Details :
Names & Synonyms: 1-hydroxypropan-2-one , 1-hydroxy-2-propanone , 1-oxidanylpropan-2-one , 1-hydroxyacetone
Smiles: CC(=O)CO
InChi : InChI=1S/C3H6O2/c1-3(5)2-4/h4H,2H2,1H3
InChi Key : InChIKey=XLSMFKSTNGKWQX-UHFFFAOYSA-N
PubChem ID : 8299
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.660221
Hydrogen bond donor count : 1 Electric dipole moment : 3.502
XLogP : -0.852 VDW volume : 75.388407
Molecular weight : 74.036779 HOMO-LUMO gap : 11.026000
Herb list :
Refrences & Litretures:
  
34.      Journal:'J Sci Food Agric'      Year:'2014'      Volume:'94'      Page:'2179'      DOI:'10.1002/jsfa.6533'      Title:'Chemical composition and bioactivity of dried fruits and honey of Ficus carica cultivars Dottato, San Francesco and Citrullara'
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