Benzothiazolium, 3-ethyl-2-methyl-, iodide


Chemical Name: Benzothiazolium, 3-ethyl-2-methyl-, iodide
CAS Number: 3119-93-5
Product Number: AG003JE9(AGN-PC-0KK3LT)
Synonyms:
MDL No:
Molecular Formula: C10H12INS
Molecular Weight: 305.1784

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
305.177g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
304.974g/mol
Monoisotopic Mass:
304.974g/mol
Topological Polar Surface Area:
32.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
160
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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