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202118-70-5 | 3-Pyridinecarboxylic acid, 1,2-dihydro-1-hydroxy-2-oxo-
CAS No: 202118-70-5 Catalog No: AG00282N MDL No:MFCD00186535
Product Description
Catalog Number:
AG00282N
Chemical Name:
3-Pyridinecarboxylic acid, 1,2-dihydro-1-hydroxy-2-oxo-
CAS Number:
202118-70-5
Molecular Formula:
C6H5NO4
Molecular Weight:
155.1082
MDL Number:
MFCD00186535
IUPAC Name:
1-hydroxy-2-oxopyridine-3-carboxylic acid
InChI:
InChI=1S/C6H5NO4/c8-5-4(6(9)10)2-1-3-7(5)11/h1-3,11H,(H,9,10)
InChI Key:
VQLWLSUQDIXNBD-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccn(c1=O)O
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
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