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Home > Nitro Compounds > 5093-64-1
5093-64-1 | 2-Acetamido-5-nitropyridine
CAS No: 5093-64-1 Catalog No: AG003B5V MDL No:MFCD00833973
Product Description
Catalog Number:
AG003B5V
Chemical Name:
2-Acetamido-5-nitropyridine
CAS Number:
5093-64-1
Molecular Formula:
C7H7N3O3
Molecular Weight:
181.1488
MDL Number:
MFCD00833973
IUPAC Name:
N-(5-nitropyridin-2-yl)acetamide
InChI:
InChI=1S/C7H7N3O3/c1-5(11)9-7-3-2-6(4-8-7)10(12)13/h2-4H,1H3,(H,8,9,11)
InChI Key:
XKAASKOXADTLIG-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(cn1)[N+](=O)[O-]
NSC Number:
402463
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.049g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
181.151g/mol
Monoisotopic Mass:
181.049g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
87.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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