chempirical

2,4-Dimethyl-1,3-oxazole-5-carboxylic acid

C6H7NO3CAS 2510-37-4141.13 g/mol

Open in Covalent MOL file
ONOHO
Carboxylic acid

Properties

Molecular formula
C6H7NO3
Molar mass
141.13 g/mol
Exact mass
141.0426 Da
logP
0.99Crippen estimate
Polar surface area
63.3 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

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
2510-37-4
SMILES
CC1=C(OC(=N1)C)C(=O)O
InChIKey
JLSFKHJNJFXGAB-UHFFFAOYSA-N
InChI
InChI=1S/C6H7NO3/c1-3-5(6(8)9)10-4(2)7-3/h1-2H3,(H,8,9)

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Names and synonyms

1 names
  • Dimethyl-1,3-oxazole-5-carboxylic acid

Work with 2,4-Dimethyl-1,3-oxazole-5-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

4-Methyl-1,3-oxazole-5-carboxylic acid2510-32-950 % similar 2-Bromo-4-methyl-1,3-thiazole-5-carboxylic acid40003-41-642 % similar Trimethyloxazole20662-84-442 % similar 3-Methyl-1,2-oxazole-4-carboxylic acid17153-20-741 % similar Dimethyl-1,3-thiazole-5-carboxylic acid53137-27-241 % similar 4,6-Dimethylpyrimidine-5-carboxylic acid157335-93-840 % similar 3-Methylpyrazine-2-carboxylic acid41110-28-539 % similar 4-Methyl-1,2,3-thiadiazole-5-carboxylic acid18212-21-038 % similar

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

Same formula

Ethyl oxazole-5-carboxylate118994-89-1 2-Isocyanatoethyl acrylate13641-96-8 N-(2-Hydroxyethyl)maleimide1585-90-6 3-Methyl-5-isoxazoleacetic acid 9819668-85-0 Methyl 5-methyl-3-isoxazolecarboxylate19788-35-3 Methyl 5-amino-2-furoate22600-30-2 Ethyl oxazole-4-carboxylate23012-14-8 3,5-Dimethyl-4-isoxazolecarboxylic acid2510-36-3

Elsewhere

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