3-Methyl-5-phenylisoxazole-4-carboxylic acid
3-methyl-5-phenyl-1,2-oxazole-4-carboxylic acid
Also Known As: 3-methyl-5-phenylisoxazole-4-carboxylic acid|3-methyl-5-phenyl-4-isoxazolecarboxylic acid|3-methyl-5-phenyl-1,2-oxazole-4-carboxylic acid|KS-00000NOC|BUTTPARK 95\50-96|SDCCGMLS-0066026.P001|4-Isoxazolecarboxylic acid, 3-methyl-5-phenyl-|CS-W021966|DS-1486|(4-Carboxy-3-methylisoxazol-5-yl)benzene|3-methyl-5-phenylisoxazole-4-carboxylicacid|4CH-015622|3-methyl-5-phenyl-4-isoxazole carboxylic acid|3-Methyl-5-phenyl-isoxazole-4-carboxylic acid|4-Isoxazolecarboxylicacid, 3-methyl-5-phenyl-|S-7384|I14-10763|641-241-7
| Molecular Formula | C11H9NO3 |
|---|---|
| Molecular Weight | 203.05824 g/mol |
| LogP | 2.34822 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.05824 |
| Monoisotopic Mass | 203.05824 |
| Heavy Atoms | 15 |
| Complexity | 487.78906 |
Chemical Identifiers
| CAS Number | 17153-21-8 |
|---|---|
| SMILES | CC1=NOC(=C1C(=O)O)C2=CC=CC=C2 |
Product Overview
3-Methyl-5-phenylisoxazole-4-carboxylic acid (CAS 17153-21-8), with molecular formula C11H9NO3 and molecular weight 203.05824 g/mol. IUPAC: 3-methyl-5-phenyl-1,2-oxazole-4-carboxylic acid.