3-Methyl-5-isoxazolecarboxylic acid
5-methyl-1,2-oxazole-3-carboxylic acid
Also Known As: 5-Methylisoxazole-3-carboxylic acid|5-methyl-1,2-oxazole-3-carboxylic acid|null|Isoxazole Acid|ISOX|3-Methylisoxazole-5-carboxylic acid|5-methyl-3-isoxazolecarboxylic acid|5-methylisoxazole-3-carboxylicacid|5-Carboxy-3-methylisoxazole|3-CARBOXY-5-METHYLISOXAZOLE|3-Methyl-5-isoxazolecarboxylic acid|5-methylisoxazol-3-carbonsaure|ACMC-209i51|644676_ALDRICH|AMOT0306|3-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-|5-methylisoxazole carboxylic acid|EINECS 222-289-4|5-Methyl-3-isooxazolecarboxylic acid|3-Isoxazolecarboxylicacid, 5-methyl-|5-methyl-isoxazole-carboxylic acid|5-methyl-3-isoxazolecarboxlic acid|3-Isoxazolecarboxylicacid,5-methyl-|5-Methyl-4-isoxazolecarboxylic acid|EINECS 225-454-9
| Molecular Formula | C5H5NO3 |
|---|---|
| Molecular Weight | 127.02694 g/mol |
| LogP | 0.68 |
| Topological Polar Surface Area | 63.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 127.02694 |
| Heavy Atoms | 9 |
| Complexity | 227.9 |
Chemical Identifiers
| CAS Number | 3405-77-4 |
|---|---|
| SMILES | CC1=CC(=NO1)C(=O)O |
Product Overview
3-Methyl-5-isoxazolecarboxylic acid (CAS 3405-77-4), with molecular formula C5H5NO3 and molecular weight 127.02694 g/mol. IUPAC: 5-methyl-1,2-oxazole-3-carboxylic acid.
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