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Home Carboxys 2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid

2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid

CAS No.:
38324-83-3
Catalog Number:
AG00BYHD
Molecular Formula:
C5H4N2O3
Molecular Weight:
140.0969
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$313
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Product Description
Catalog Number:
AG00BYHD
Chemical Name:
2-Oxo-1,2-dihydropyrimidine-5-carboxylic acid
CAS Number:
38324-83-3
Molecular Formula:
C5H4N2O3
Molecular Weight:
140.0969
MDL Number:
MFCD08236864
IUPAC Name:
2-oxo-1H-pyrimidine-5-carboxylic acid
InChI:
InChI=1S/C5H4N2O3/c8-4(9)3-1-6-5(10)7-2-3/h1-2H,(H,8,9)(H,6,7,10)
InChI Key:
CRCVTNHORFBTSX-UHFFFAOYSA-N
SMILES:
Oc1ncc(cn1)C(=O)O
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
140.022g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
140.098g/mol
Monoisotopic Mass:
140.022g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  
Literature
Title Journal
Synthesis of imidazolidin-2-one-4-carboxylate and of (tetrahydro)pyrimidin-2-one-5-carboxylate via an efficient modification of the Hofmann rearrangement. Organic & biomolecular chemistry 20080521
Properties