2,1,3-Benzothiadiazole-4-sulfonyl chloride


Chemical Name: 2,1,3-Benzothiadiazole-4-sulfonyl chloride
CAS Number: 73713-79-8
Product Number: AG0036LR(AGN-PC-0KK744)
Synonyms:
MDL No:
Molecular Formula: C6H3ClN2O2S2
Molecular Weight: 234.6832

Identification/Properties


Properties
MP:
148 °C
BP:
359.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
234.672g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
233.932g/mol
Monoisotopic Mass:
233.932g/mol
Topological Polar Surface Area:
96.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
290
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
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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