1-ethyl-3-methylimidazol-3-ium;4-methylbenzenesulfonate


Chemical Name: 1-ethyl-3-methylimidazol-3-ium;4-methylbenzenesulfonate
CAS Number: 328090-25-1
Product Number: AG003B1Q(AGN-PC-0N7YHC)
Synonyms:
MDL No:
Molecular Formula: C13H18N2O3S
Molecular Weight: 282.3586

Identification/Properties


Properties
MP:
25-35 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
282.358g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
282.104g/mol
Monoisotopic Mass:
282.104g/mol
Topological Polar Surface Area:
74.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
266
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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