3-Methyl-1,2-oxazole-4-carboxylic acid
TL;DR: 3-Methyl-1,2-oxazole-4-carboxylic acid (CAS 17153-20-7) is a chemical compound with molecular formula C5H5NO3 and molecular weight 127.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1,2-oxazole-4-carboxylic acid
Also Known As: 3-Methylisoxazole-4-carboxylic acid, 3-methyl-4-isoxazolecarboxylic acid, 3-methyl-1,2-oxazole-4-carboxylic Acid, 5-Indolylboronic acid, Leflunomide Impurity 18
| Molecular Formula | C5H5NO3 |
|---|---|
| Molecular Weight | 127.03 g/mol |
| LogP | 0.68122 |
| 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 | 227.86191 |
Chemical Identifiers
| CAS Number | 17153-20-7 |
|---|---|
| SMILES | CC1=NOC=C1C(=O)O |
Product Overview
3-Methyl-1,2-oxazole-4-carboxylic acid (CAS 17153-20-7), with molecular formula C5H5NO3 and molecular weight 127.03 g/mol. IUPAC: 3-methyl-1,2-oxazole-4-carboxylic acid.
Chemical Property Profile of 3-Methyl-1,2-oxazole-4-carboxylic acid
Property Insights of 3-Methyl-1,2-oxazole-4-carboxylic acid
The XLogP value of 0.68122 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-1,2-oxazole-4-carboxylic acid. The TPSA of 63.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Methyl-1,2-oxazole-4-carboxylic acid. Following Lipinski's Rule of Five, 3-Methyl-1,2-oxazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-Methyl-1,2-oxazole-4-carboxylic acid?
The CAS number of 3-Methyl-1,2-oxazole-4-carboxylic acid is 17153-20-7.
What is the molecular formula of 3-Methyl-1,2-oxazole-4-carboxylic acid?
The molecular formula of 3-Methyl-1,2-oxazole-4-carboxylic acid is C5H5NO3.
What is the molecular weight of 3-Methyl-1,2-oxazole-4-carboxylic acid?
The molecular weight of 3-Methyl-1,2-oxazole-4-carboxylic acid is 127.03 g/mol.
Where can I buy 3-Methyl-1,2-oxazole-4-carboxylic acid?
You can request a quote for 3-Methyl-1,2-oxazole-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1,2-oxazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1,2-oxazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.