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Home > Nitro Compounds > 6654-82-6
6654-82-6 | Acetamide, N-(5-nitro-1-oxido-2-pyridinyl)- (9CI)
CAS No: 6654-82-6 Catalog No: AG00FI2V MDL No:
Product Description
Catalog Number:
AG00FI2V
Chemical Name:
Acetamide, N-(5-nitro-1-oxido-2-pyridinyl)- (9CI)
CAS Number:
6654-82-6
Molecular Formula:
C7H7N3O4
Molecular Weight:
197.1482
IUPAC Name:
N-(1-hydroxy-5-nitropyridin-2-ylidene)acetamide
InChI:
InChI=1S/C7H7N3O4/c1-5(11)8-7-3-2-6(10(13)14)4-9(7)12/h2-4,12H,1H3
InChI Key:
FOJADYRNFBUAIR-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1ccc(c[n+]1[O-])[N+](=O)[O-]
Properties
Complexity:
364
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.044g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
197.15g/mol
Monoisotopic Mass:
197.044g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
98.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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