1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, sodium salt, hydrate


Chemical Name: 1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, sodium salt, hydrate
CAS Number: 82385-42-0
Product Number: AG00ID8L(AGN-PC-0UM058)
Synonyms:
MDL No:
Molecular Formula: C7H6NNaO4S
Molecular Weight: 223.1816

Identification/Properties


Computed Properties
Molecular Weight:
223.178g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
222.992g/mol
Monoisotopic Mass:
222.992g/mol
Topological Polar Surface Area:
61.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
308
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:
3
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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