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ScientificNameLabel
Methyl allyl disulfide
PHCD compound ID : 3381
Chemical Names :
Methyl allyl disulfide , Allyl methyl disulfide , Disulfide,-methyl 2-propenyl , Methyl-allyl-disulfide
Molecular Formula : C4H8S2
Molecular Weight : 120.006742
More Details :
Names & Synonyms: 3-(methyldisulfanyl)prop-1-ene , 3-(methyldisulfanyl)-1-propene
Smiles: CSSCC=C
InChi : InChI=1S/C4H8S2/c1-3-4-6-5-2/h3H,1,4H2,2H3
InChi Key : InChIKey=XNZOTQPMYMCTBZ-UHFFFAOYSA-N
PubChem ID : 62434
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.796074
Hydrogen bond donor count : 0 Electric dipole moment : 2.244
XLogP : 1.916 VDW volume : 112.121987
Molecular weight : 120.006742 HOMO-LUMO gap : 7.919000
Herb list :
Refrences & Litretures:
  
466.      Journal:'Journal of Essential Oil Research'      Year:'2014'      Volume:'26'      Page:'91'      DOI:'10.1080/10412905.2013.868329'      Title:'Composition of garlic essential oil (Allium sativum L.) as influenced by drying method'
467.      Journal:'Journal of Economic Entomology'      Year:'2013'      Volume:'106'      Page:'1349'      DOI:'10.1603/EC12191'      Title:'Evaluation of Acute Toxicity of Essential Oil of Garlic (Allium sativum) and Its Selected Major Constituent Compounds Against Overwintering Cacopsylla chinensis (Hemiptera: Psyllidae)'
468.      Journal:'IOSR-JESTFT'      Year:'2013'      Volume:'3'      Page:'30'      DOI:''      Title:'Chemical composition and biological activity of Allium sativum essential oils against Callosobruchus maculatus'
470.      Journal:'J Food Sci'      Year:'2012'      Volume:'77'      Page:'M278'      DOI:'10.1111/j.1750-3841.2012.02662.x'      Title:'Effects of Onion (Allium cepa L.) and Garlic (Allium sativum L.) Essential Oils on the Aspergillus versicolor Growth and Sterigmatocystin Production'
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