Home Carboxys 2-hydroxy-6-methyl-3-nitropyridine-4-carboxylic acid

2-hydroxy-6-methyl-3-nitropyridine-4-carboxylic acid

CAS No.:
1369136-38-8
Catalog Number:
AG01BGZE
Molecular Formula:
C7H6N2O5
Molecular Weight:
198.1329
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Product Description
Catalog Number:
AG01BGZE
Chemical Name:
2-hydroxy-6-methyl-3-nitropyridine-4-carboxylic acid
CAS Number:
1369136-38-8
Molecular Formula:
C7H6N2O5
Molecular Weight:
198.1329
MDL Number:
MFCD22059322
IUPAC Name:
6-methyl-3-nitro-2-oxo-1H-pyridine-4-carboxylic acid
InChI:
InChI=1S/C7H6N2O5/c1-3-2-4(7(11)12)5(9(13)14)6(10)8-3/h2H,1H3,(H,8,10)(H,11,12)
InChI Key:
DPHIJIKDXJKLLR-UHFFFAOYSA-N
SMILES:
Cc1nc(O)c(c(c1)C(=O)O)[N+](=O)[O-]
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
198.134g/mol
Monoisotopic Mass:
198.028g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1  
Properties