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ScientificNameLabel
1-Propanethiol
PHCD compound ID : 5052
Chemical Names :
1-Propanethiol
Molecular Formula : C3H8S1
Molecular Weight : 76.034671
More Details :
Names & Synonyms: propane-1-thiol , 1-propanethiol
Smiles: CCCS
InChi : InChI=1S/C3H8S/c1-2-3-4/h4H,2-3H2,1H3
InChi Key : InChIKey=SUVIGLJNEAMWEG-UHFFFAOYSA-N
PubChem ID : 7848
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.873034
Hydrogen bond donor count : 0 Electric dipole moment : 2.173
XLogP : 1.663 VDW volume : 78.953437
Molecular weight : 76.034671 HOMO-LUMO gap : 8.626000
Herb list :
Refrences & Litretures:
  
786.      Journal:'Journal of Food Quality'      Year:'2017'      Volume:''      Page:'6873651'      DOI:'10.1155/2017/6873651'      Title:'Chemical Composition and Antioxidant Properties of Five White Onion (Allium cepa L.) Landraces'
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