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Home > Imidazoles > 90964-32-2
90964-32-2 | Acetamide, N-(5-nitro-1H-benzimidazol-2-yl)-
CAS No: 90964-32-2 Catalog No: AG006SMC MDL No:
Product Description
Catalog Number:
AG006SMC
Chemical Name:
Acetamide, N-(5-nitro-1H-benzimidazol-2-yl)-
CAS Number:
90964-32-2
Molecular Formula:
C9H8N4O3
Molecular Weight:
220.1848
IUPAC Name:
N-(6-nitro-1H-benzimidazol-2-yl)acetamide
InChI:
InChI=1S/C9H8N4O3/c1-5(14)10-9-11-7-3-2-6(13(15)16)4-8(7)12-9/h2-4H,1H3,(H2,10,11,12,14)
InChI Key:
ZLHASRQVZQYAQU-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1nc2c([nH]1)ccc(c2)[N+](=O)[O-]
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.06g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
220.188g/mol
Monoisotopic Mass:
220.06g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
104A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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