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Propylene sulfide
ScientificNameLabel
Propylene sulfide
PHCD compound ID :
5053
Chemical Names :
Propylene sulfide
Molecular Formula :
C3H6S1
Molecular Weight :
74.019021
More Details :
Names & Synonyms:
2-methylthiirane
Smiles:
C[C@H]1CS1
InChi :
InChI=1S/C3H6S/c1-3-2-4-3/h3H,2H2,1H3/t3-/m0/s1
InChi Key :
InChIKey=MBNVSWHUJDDZRH-VKHMYHEASA-N
PubChem ID :
14072
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
8.858196
Hydrogen bond donor count :
0
Electric dipole moment :
2.190
XLogP :
1.268
VDW volume :
66.596978
Molecular weight :
74.019021
HOMO-LUMO gap :
8.344000
Herb list :
Onoin - Allium cepa - پیاز
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'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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