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Methyl 1-(methylthio) propyl disulfide
PHCD compound ID : 785
Chemical Names :
Methyl 1-(methylthio) propyl disulfide
Molecular Formula : C5H12S3
Molecular Weight : 168.010113
More Details :
Names & Synonyms: 1-(methyldisulfanyl)-1-methylsulfanyl-propane , 1-(methyldisulfanyl)-1-(methylthio)propane , 1-(methyldisulfanyl)-1-methylsulfanylpropane
Smiles: CSS[C@H](SC)CC
InChi : InChI=1S/C5H12S3/c1-4-5(6-2)8-7-3/h5H,4H2,1-3H3/t5-/m0/s1
InChi Key : InChIKey=OGKCJWOOFUPRSV-YFKPBYRVSA-N
PubChem ID : 521472
Rotatable bond count : 4 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.592408
Hydrogen bond donor count : 0 Electric dipole moment : 2.487
XLogP : 2.834 VDW volume : 150.563454
Molecular weight : 168.010113 HOMO-LUMO gap : 7.777000
Herb list :
Refrences & Litretures:
  
54.      Journal:'Research Journal of Pharmacognosy'      Year:'2014'      Volume:'1'      Page:'51'      DOI:''      Title:'Assessment of chemical composition of essential oil of Ferula assa-foetida oleogum-resin from two different sites of Yazd province in center of Iran'
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