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Home > Sulfanilamide > 89517-96-4
89517-96-4 | 1H-1,2,4-Triazole-3-sulfonamide
CAS No: 89517-96-4 Catalog No: AG0038D7 MDL No:MFCD18207305
Product Description
Catalog Number:
AG0038D7
Chemical Name:
1H-1,2,4-Triazole-3-sulfonamide
CAS Number:
89517-96-4
Molecular Formula:
C2H4N4O2S
Molecular Weight:
148.1438
MDL Number:
MFCD18207305
IUPAC Name:
1H-1,2,4-triazole-5-sulfonamide
InChI:
InChI=1S/C2H4N4O2S/c3-9(7,8)2-4-1-5-6-2/h1H,(H2,3,7,8)(H,4,5,6)
InChI Key:
WXJWETDFIWKUHH-UHFFFAOYSA-N
SMILES:
NS(=O)(=O)c1n[nH]cn1
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.005g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
148.14g/mol
Monoisotopic Mass:
148.005g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
110A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.1
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