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Home > Nitro Compounds > 88398-92-9
88398-92-9 | 1H-Pyrazole-5-sulfonamide, 1,3-dimethyl-4-nitro-
CAS No: 88398-92-9 Catalog No: AG004LH0 MDL No:
Product Description
Catalog Number:
AG004LH0
Chemical Name:
1H-Pyrazole-5-sulfonamide, 1,3-dimethyl-4-nitro-
CAS Number:
88398-92-9
Molecular Formula:
C5H8N4O4S
Molecular Weight:
220.2064
IUPAC Name:
2,5-dimethyl-4-nitropyrazole-3-sulfonamide
InChI:
InChI=1S/C5H8N4O4S/c1-3-4(9(10)11)5(8(2)7-3)14(6,12)13/h1-2H3,(H2,6,12,13)
InChI Key:
IUAIOZJBFUEYQD-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(C)nn(c1S(=O)(=O)N)C
Properties
Complexity:
331
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.027g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.203g/mol
Monoisotopic Mass:
220.027g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
132A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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