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99780-72-0 | 3-sulfanylpyridine-2-sulfonamide
CAS No: 99780-72-0 Catalog No: AG003WGX MDL No:
Product Description
Catalog Number:
AG003WGX
Chemical Name:
3-sulfanylpyridine-2-sulfonamide
CAS Number:
99780-72-0
Molecular Formula:
C5H6N2O2S2
Molecular Weight:
190.2433
IUPAC Name:
3-sulfanylpyridine-2-sulfonamide
InChI:
InChI=1S/C5H6N2O2S2/c6-11(8,9)5-4(10)2-1-3-7-5/h1-3,10H,(H2,6,8,9)
InChI Key:
XXONZJKORUUFIZ-UHFFFAOYSA-N
SMILES:
Sc1cccnc1S(=O)(=O)N
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.987g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.235g/mol
Monoisotopic Mass:
189.987g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
82.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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