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Home > Indoles and Oxindole > 128200-32-8
128200-32-8 | 1H-Indole-3-carboxamide, 5-nitro-
CAS No: 128200-32-8 Catalog No: AG000XVC MDL No:MFCD22493435
Product Description
Catalog Number:
AG000XVC
Chemical Name:
1H-Indole-3-carboxamide, 5-nitro-
CAS Number:
128200-32-8
Molecular Formula:
C9H7N3O3
Molecular Weight:
205.1702
MDL Number:
MFCD22493435
IUPAC Name:
5-nitro-1H-indole-3-carboxamide
InChI:
InChI=1S/C9H7N3O3/c10-9(13)7-4-11-8-2-1-5(12(14)15)3-6(7)8/h1-4,11H,(H2,10,13)
InChI Key:
KQXIVONHGWKTQB-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc2c(c1)c(c[nH]2)C(=O)N
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.049g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
205.173g/mol
Monoisotopic Mass:
205.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
Literature
| Title | Journal |
|---|---|
| Evolving a polymerase for hydrophobic base analogues. | Journal of the American Chemical Society 20091021 |
| Solution structure and dynamics of DNA duplexes containing the universal base analogues 5-nitroindole and 5-nitroindole 3-carboxamide. | Nucleic acids research 20070501 |
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