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cis-Methyl-1-propenyl disulfide
ScientificNameLabel
cis-Methyl-1-propenyl disulfide
PHCD compound ID :
5055
Chemical Names :
cis-Methyl-1-propenyl disulfide
Molecular Formula :
C4H8S2
Molecular Weight :
120.006742
More Details :
Names & Synonyms:
(Z)-1-(methyldisulfanyl)prop-1-ene , (Z)-1-(methyldisulfanyl)-1-propene , (
Z
)-1-(methyldisulfanyl)prop-1-ene
Smiles:
CSS/C=C\C
InChi :
InChI=1S/C4H8S2/c1-3-4-6-5-2/h3-4H,1-2H3/b4-3-
InChi Key :
InChIKey=FUDUFCLRGSEHAJ-ARJAWSKDSA-N
PubChem ID :
6164465
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
8.615500
Hydrogen bond donor count :
0
Electric dipole moment :
2.337
XLogP :
2.237
VDW volume :
112.121987
Molecular weight :
120.006742
HOMO-LUMO gap :
7.822000
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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