Home Carboxys 5-acetamido-2-hydroxypyridine-3-carboxylic acid

5-acetamido-2-hydroxypyridine-3-carboxylic acid

CAS No.:
89977-03-7
Catalog Number:
AG01B6W9
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
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Product Description
Catalog Number:
AG01B6W9
Chemical Name:
5-acetamido-2-hydroxypyridine-3-carboxylic acid
CAS Number:
89977-03-7
Molecular Formula:
C8H8N2O4
Molecular Weight:
196.1601
MDL Number:
MFCD30497518
IUPAC Name:
5-acetamido-2-oxo-1H-pyridine-3-carboxylic acid
InChI:
InChI=1S/C8H8N2O4/c1-4(11)10-5-2-6(8(13)14)7(12)9-3-5/h2-3H,1H3,(H,9,12)(H,10,11)(H,13,14)
InChI Key:
LCOZTTRDDFOZOW-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cnc(c(c1)C(=O)O)O
Properties
Complexity:
368  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.048g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
196.162g/mol
Monoisotopic Mass:
196.048g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
95.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties