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Compound: 5546
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Dipropyl disulfide
ScientificNameLabel
Dipropyl disulfide
PHCD compound ID :
5058
Chemical Names :
Dipropyl disulfide
Molecular Formula :
C6H14S2
Molecular Weight :
150.053692
More Details :
Names & Synonyms:
1-(propyldisulfanyl)propane
Smiles:
CCCSSCCC
InChi :
InChI=1S/C6H14S2/c1-3-5-7-8-6-4-2/h3-6H2,1-2H3
InChi Key :
InChIKey=ALVPFGSHPUPROW-UHFFFAOYSA-N
PubChem ID :
12377
Rotatable bond count :
5
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
8.705476
Hydrogen bond donor count :
0
Electric dipole moment :
2.677
XLogP :
2.998
VDW volume :
149.350415
Molecular weight :
150.053692
HOMO-LUMO gap :
7.939000
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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