5304-18-7
2,6-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM IODIDE
Name2,6-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM IODIDE
pro_formulaC11 H14 N S . I
1Identification
【Name】
2,6-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM IODIDE
【CAS】
【MDL】
MFCD00044148
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C11 H14 N S . I
【pro_molWeight】
319.205
【Inchi】
InChI=1S/C11H14NS.HI/c1-4-12-9(3)13-11-7-8(2)5-6-10(11)12;/h5-7H,4H2,1-3H3;1H/q+1;/p-1
【InChIKey】
InChIKey=LKTNFBVQAYVDIX-UHFFFAOYSA-M
【SMILES】
CC[n+]1c(sc2c1ccc(c2)C)C.[I-]
【MOL File】
2,6-DIMETHYL-3-ETHYL….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:1
XLogP3:0.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2,6-DIMETHYL-3-ETHYLBENZOTHIAZOLIUM IODIDE.cml