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Home > Sulfanilamide > 88398-48-5
88398-48-5 | 1H-Pyrazole-4-sulfonamide, 1,3-dimethyl-5-(propylsulfonyl)-
CAS No: 88398-48-5 Catalog No: AG008D5L MDL No:
Product Description
Catalog Number:
AG008D5L
Chemical Name:
1H-Pyrazole-4-sulfonamide, 1,3-dimethyl-5-(propylsulfonyl)-
CAS Number:
88398-48-5
Molecular Formula:
C8H15N3O4S2
Molecular Weight:
281.3524
IUPAC Name:
1,3-dimethyl-5-propylsulfonylpyrazole-4-sulfonamide
InChI:
InChI=1S/C8H15N3O4S2/c1-4-5-16(12,13)8-7(17(9,14)15)6(2)10-11(8)3/h4-5H2,1-3H3,(H2,9,14,15)
InChI Key:
CLZVIULAQUSRCK-UHFFFAOYSA-N
SMILES:
CCCS(=O)(=O)c1n(C)nc(c1S(=O)(=O)N)C
Properties
Complexity:
462
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.05g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
281.345g/mol
Monoisotopic Mass:
281.05g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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