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Home > Sulfanilamide > 117588-09-7
117588-09-7 | 1,2,4-Thiadiazole-5-sulfonamide, 3-phenyl-
CAS No: 117588-09-7 Catalog No: AG007QX0 MDL No:
Product Description
Catalog Number:
AG007QX0
Chemical Name:
1,2,4-Thiadiazole-5-sulfonamide, 3-phenyl-
CAS Number:
117588-09-7
Molecular Formula:
C8H7N3O2S2
Molecular Weight:
241.2901
IUPAC Name:
3-phenyl-1,2,4-thiadiazole-5-sulfonamide
InChI:
InChI=1S/C8H7N3O2S2/c9-15(12,13)8-10-7(11-14-8)6-4-2-1-3-5-6/h1-5H,(H2,9,12,13)
InChI Key:
TYUTWZVHTYQMDI-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1snc(n1)c1ccccc1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.998g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
241.283g/mol
Monoisotopic Mass:
240.998g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
123A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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