Home Carboxys 1-Hydroxy-6-oxo-1,6-dihydropyridine-2-carboxylic acid

1-Hydroxy-6-oxo-1,6-dihydropyridine-2-carboxylic acid

CAS No.:
94781-89-2
Catalog Number:
AG005V95
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$81
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Product Description
Catalog Number:
AG005V95
Chemical Name:
1-Hydroxy-6-oxo-1,6-dihydropyridine-2-carboxylic acid
CAS Number:
94781-89-2
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
MDL Number:
MFCD20270107
IUPAC Name:
1-hydroxy-6-oxopyridine-2-carboxylic acid
InChI:
InChI=1S/C6H5NO4/c8-5-3-1-2-4(6(9)10)7(5)11/h1-3,11H,(H,9,10)
InChI Key:
QJEZBSWVHDOAFS-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(=O)n1O
Properties
Complexity:
266  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
155.022g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
155.109g/mol
Monoisotopic Mass:
155.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
77.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Literature
Title Journal
Identifying chelators for metalloprotein inhibitors using a fragment-based approach. Journal of medicinal chemistry 20110127
Properties