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Dihydro-6-methyl-2,4-diethyl-4H-1,3,5-dithiazine 5,6-
ScientificNameLabel
Dihydro-6-methyl-2,4-diethyl-4H-1,3,5-dithiazine 5,6-
PHCD compound ID :
5069
Chemical Names :
Dihydro-6-methyl-2,4-diethyl-4H-1,3,5-dithiazine 5,6-
Molecular Formula :
C8H17N1S2
Molecular Weight :
191.080242
More Details :
Names & Synonyms:
2,4-diethyl-6-methyl-1,3,5-dithiazinane
Smiles:
CC[C@H]1N[C@@H](C)S[C@@H](S1)CC
InChi :
InChI=1S/C8H17NS2/c1-4-7-9-6(3)10-8(5-2)11-7/h6-9H,4-5H2,1-3H3/t6-,7+,8+/m1/s1
InChi Key :
InChIKey=AQKSWRRFZAIKOU-CSMHCCOUSA-N
PubChem ID :
85840817
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
8.628665
Hydrogen bond donor count :
1
Electric dipole moment :
2.349
XLogP :
2.415
VDW volume :
182.582685
Molecular weight :
191.080242
HOMO-LUMO gap :
8.453000
Herb list :
Onoin - Allium cepa - پیاز
Refrences & Litretures:
788. Journal:'Australian Journal of Basic and Applied Sciences' Year:'2009' Volume:'3' Page:'201' DOI:'' Title:'Essential Oil, Growth and Yield of Onion (Allium Cepa L.) In Response to Foliar Application of Some Micronutrients'
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