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Home > Nitro Compounds > 16013-84-6
16013-84-6 | 2(1H)-Pyridinone, 6-hydroxy-3-nitro-
CAS No: 16013-84-6 Catalog No: AG001RPF MDL No:MFCD00955642
Product Description
Catalog Number:
AG001RPF
Chemical Name:
2(1H)-Pyridinone, 6-hydroxy-3-nitro-
CAS Number:
16013-84-6
Molecular Formula:
C5H4N2O4
Molecular Weight:
156.0963
MDL Number:
MFCD00955642
IUPAC Name:
6-hydroxy-5-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C5H4N2O4/c8-4-2-1-3(7(10)11)5(9)6-4/h1-2H,(H2,6,8,9)
InChI Key:
OANIJGWISUGBFS-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc([nH]c1=O)O
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
156.017g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
156.097g/mol
Monoisotopic Mass:
156.017g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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