chempirical

2,6-Dimethoxypyrimidine-4-carboxylic acid

C7H8N2O4CAS 59864-30-1184.15 g/mol

Open in Covalent MOL file
ONNOOHO
Carboxylic acidEther

Properties

Molecular formula
C7H8N2O4
Molar mass
184.15 g/mol
Exact mass
184.0484 Da
logP
0.19Crippen estimate
Polar surface area
81.5 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
3

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
59864-30-1
SMILES
COC1=NC(=NC(=C1)C(=O)O)OC
InChIKey
APCAETLUMQRTDK-UHFFFAOYSA-N
InChI
InChI=1S/C7H8N2O4/c1-12-5-3-4(6(10)11)8-7(9-5)13-2/h3H,1-2H3,(H,10,11)

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Names and synonyms

1 names
  • 2,4-Dimethoxypyrimidine-6-carboxylic acid

Work with 2,6-Dimethoxypyrimidine-4-carboxylic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

6-Methoxypicolinic acid26893-73-255 % similar 2,4,6-Trimethoxypyrimidine13106-85-955 % similar Bispyribac125401-75-453 % similar 5-Methoxy-2-pyrazinecarboxylic acid40155-42-853 % similar 6-Methoxypyridazine-3-carboxylic acid56434-28-753 % similar 2-Chloro-6-methoxypyridine-4-carboxylic acid15855-06-851 % similar 4-Methoxy-2-quinolinecarboxylic acid15733-83-249 % similar 2-Methoxy-4-pyridinecarboxylic acid105596-63-246 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

2,6-Dimethoxy-3-nitropyridine18677-41-3 2-(5-Methyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-yl)acetic acid20924-05-4 Ethyl 1,2,3,4-tetrahydro-2,4-dioxo-5-pyrimidinecarboxylate28485-17-8 4,5-Dimethyl 1H-imidazole-4,5-dicarboxylate3304-70-9 Dimethyl 1H-pyrazole-3,5-dicarboxylate4077-76-3 Ethyl 4-Nitropyrrole-2-carboxylate5930-92-7

Elsewhere

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