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1,3-Dithiane
ScientificNameLabel
1,3-Dithiane
PHCD compound ID :
3386
Chemical Names :
1,3-Dithiane , 1,3 dithiane
Molecular Formula :
C4H8S2
Molecular Weight :
120.006742
More Details :
Names & Synonyms:
1,3-dithiane
Smiles:
C1CCSCS1
InChi :
InChI=1S/C4H8S2/c1-2-5-4-6-3-1/h1-4H2
InChi Key :
InChIKey=WQADWIOXOXRPLN-UHFFFAOYSA-N
PubChem ID :
10451
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
8.543589
Hydrogen bond donor count :
0
Electric dipole moment :
2.496
XLogP :
1.942
VDW volume :
102.401987
Molecular weight :
120.006742
HOMO-LUMO gap :
8.498000
Herb list :
Garlic - Allium sativum - سیر
Refrences & Litretures:
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'
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