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Pyrimidine-2-carboxylic acid sodium (HCID 40428945)|Huagongshe
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Compound
Pyrimidine-2-carboxylic acid sodium
HCID
40428945
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Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
O=C([O-])c1ncccn1
InChIKey
ZFCHNZDUMIOWFV-UHFFFAOYSA-M
Molecular formula
C5H3N2O2-
Average molar mass
123.09 g/mol
Names & identifiers
Preferred name
Pyrimidine-2-carboxylic acid sodium
IUPAC
pyrimidine-2-carboxylate
Names & synonyms
PYRIMIDINE-2-CARBOXYLIC ACID SODIUM
pyrimidine-2-carboxylate
ZFCHNZDUMIOWFV-UHFFFAOYSA-M
Database identifiers
PubChem CID
40428945
Nikkaji
J2.578.952K
Properties
Computed structural properties
XLogP
0.1
Topological polar surface area
65.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
0
Heavy atoms
9
Formal charge
-1
Complexity
104
Show all 8
Show all 8 / 8
Related reactions
2 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
203869
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
2310292
As reactant
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Compound notes
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