1H-Imidazole-2-sulfonyl chloride, 1-methyl-


Chemical Name: 1H-Imidazole-2-sulfonyl chloride, 1-methyl-
CAS Number: 55694-81-0
Product Number: AG00DBD9(AGN-PC-00DKKL)
Synonyms:
MDL No:
Molecular Formula: C4H5ClN2O2S
Molecular Weight: 180.6127

Identification/Properties


Properties
MP:
66-71 °C
BP:
355.8°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
180.606g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
179.976g/mol
Monoisotopic Mass:
179.976g/mol
Topological Polar Surface Area:
60.3A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
210
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3261
Hazard Statements:
H314-H334
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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