Home Carboxys 4-Pyridinecarboxylic acid, 2,3-dihydro-2-oxo-

4-Pyridinecarboxylic acid, 2,3-dihydro-2-oxo-

CAS No.:
169253-31-0
Catalog Number:
AG00HZA5
Molecular Formula:
C6H5NO3
Molecular Weight:
139.1088
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Product Description
Catalog Number:
AG00HZA5
Chemical Name:
4-Pyridinecarboxylic acid, 2,3-dihydro-2-oxo-
CAS Number:
169253-31-0
Molecular Formula:
C6H5NO3
Molecular Weight:
139.1088
MDL Number:
MFCD01318566
IUPAC Name:
2-oxo-1H-pyridine-4-carboxylic acid
InChI:
InChI=1S/C6H5NO3/c8-5-3-4(6(9)10)1-2-7-5/h1-3H,(H,7,8)(H,9,10)
InChI Key:
BXHCJLRTXPHUGH-UHFFFAOYSA-N
SMILES:
O=C1N=CC=C(C1)C(=O)O
NSC Number:
132888
Properties
Complexity:
239  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.027g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
139.11g/mol
Monoisotopic Mass:
139.027g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5  
Properties