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Home > Nitro Compounds > 163803-34-7
163803-34-7 | 2(1H)-Pyridinone, 4-hydroxy-5,6-dimethyl-3-nitro-
CAS No: 163803-34-7 Catalog No: AG001UEI MDL No:MFCD11113400
Product Description
Catalog Number:
AG001UEI
Chemical Name:
2(1H)-Pyridinone, 4-hydroxy-5,6-dimethyl-3-nitro-
CAS Number:
163803-34-7
Molecular Formula:
C7H8N2O4
Molecular Weight:
184.1494
MDL Number:
MFCD11113400
IUPAC Name:
4-hydroxy-5,6-dimethyl-3-nitro-1H-pyridin-2-one
InChI:
InChI=1S/C7H8N2O4/c1-3-4(2)8-7(11)5(6(3)10)9(12)13/h1-2H3,(H2,8,10,11)
InChI Key:
ZGHUDFKJBIXWMP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1c(=O)[nH]c(c(c1O)C)C
Properties
Complexity:
348
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.048g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
184.151g/mol
Monoisotopic Mass:
184.048g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
95.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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