Home Carboxys 5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester (9CI)

5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester (9CI)

CAS No.:
50628-34-7
Catalog Number:
AG00DHX5
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DHX5
Chemical Name:
5-Pyrimidinecarboxylic acid, 1,2-dihydro-2-oxo-, methyl ester (9CI)
CAS Number:
50628-34-7
MDL Number:
MFCD18969371
IUPAC Name:
methyl 2-oxo-1H-pyrimidine-5-carboxylate
InChI:
InChI=1S/C6H6N2O3/c1-11-5(9)4-2-7-6(10)8-3-4/h2-3H,1H3,(H,7,8,10)
InChI Key:
QYDSKAQQVIKEOK-UHFFFAOYSA-N
Properties
Complexity:
255  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.038g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.125g/mol
Monoisotopic Mass:
154.038g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.6  
Properties