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132829-86-8 | 4-Pyridinecarboxylic acid, 1,2-dihydro-5-hydroxy-2-oxo-
CAS No: 132829-86-8 Catalog No: AG00118H MDL No:MFCD18820837
Product Description
Catalog Number:
AG00118H
Chemical Name:
4-Pyridinecarboxylic acid, 1,2-dihydro-5-hydroxy-2-oxo-
CAS Number:
132829-86-8
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
MDL Number:
MFCD18820837
IUPAC Name:
5-hydroxy-2-oxo-1H-pyridine-4-carboxylic acid
InChI:
InChI=1S/C6H5NO4/c8-4-2-7-5(9)1-3(4)6(10)11/h1-2,8H,(H,7,9)(H,10,11)
InChI Key:
UYRASLSEKLBIJP-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc(=O)[nH]cc1O
Properties
Complexity:
276
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:
3
Isotope Atom Count:
0
Molecular Weight:
155.109g/mol
Monoisotopic Mass:
155.022g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
86.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6
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