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Home > Nitro Compounds > 101654-28-8
101654-28-8 | 4-Pyridinol, 2-nitro-
CAS No: 101654-28-8 Catalog No: AG00053N MDL No:MFCD04114170
Product Description
Catalog Number:
AG00053N
Chemical Name:
4-Pyridinol, 2-nitro-
CAS Number:
101654-28-8
Molecular Formula:
C5H4N2O3
Molecular Weight:
140.0969
MDL Number:
MFCD04114170
IUPAC Name:
2-nitro-1H-pyridin-4-one
InChI:
InChI=1S/C5H4N2O3/c8-4-1-2-6-5(3-4)7(9)10/h1-3H,(H,6,8)
InChI Key:
NJTUZNXKDOUPHP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(O)ccn1
Properties
Complexity:
236
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.022g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
140.098g/mol
Monoisotopic Mass:
140.022g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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