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Home > Imidazoles > 88422-29-1
88422-29-1 | 1H-Benzimidazole-1-sulfonamide, 2-cyano-N,N-dimethyl-6-nitro-
CAS No: 88422-29-1 Catalog No: AG004KGG MDL No:
Product Description
Catalog Number:
AG004KGG
Chemical Name:
1H-Benzimidazole-1-sulfonamide, 2-cyano-N,N-dimethyl-6-nitro-
CAS Number:
88422-29-1
Molecular Formula:
C10H9N5O4S
Molecular Weight:
295.2746
IUPAC Name:
2-cyano-N,N-dimethyl-6-nitrobenzimidazole-1-sulfonamide
InChI:
InChI=1S/C10H9N5O4S/c1-13(2)20(18,19)14-9-5-7(15(16)17)3-4-8(9)12-10(14)6-11/h3-5H,1-2H3
InChI Key:
HMVMMIBYVJPKOP-UHFFFAOYSA-N
SMILES:
N#Cc1nc2c(n1S(=O)(=O)N(C)C)cc(cc2)[N+](=O)[O-]
Properties
Complexity:
542
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.038g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
295.273g/mol
Monoisotopic Mass:
295.038g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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