2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid
TL;DR: 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid (CAS 906728-33-4) is a chemical compound with molecular formula C5H5NO4 and molecular weight 143.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-oxo-4H-1,3-oxazole-4-carboxylic acid
Also Known As: 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid, 2-methyl-5-oxo-4H-1,3-oxazole-4-carboxylic acid, 2-methyl-5-oxo-4H-oxazole-4-carboxylic acid, 4-Oxazolecarboxylicacid, 4,5-dihydro-2-methyl-5-oxo-, 4-Oxazolecarboxylicacid,4,5-dihydro-2-methyl-5-oxo
| Molecular Formula | C5H5NO4 |
|---|---|
| Molecular Weight | 143.02 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 76.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.02185 |
| Heavy Atoms | 10 |
| Complexity | 220.0 |
Chemical Identifiers
| CAS Number | 906728-33-4 |
|---|---|
| SMILES | CC1=NC(C(=O)O1)C(=O)O |
| InChIKey | BVTRLVSCYJALOP-UHFFFAOYSA-N |
Product Overview
2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid (CAS 906728-33-4), with molecular formula C5H5NO4 and molecular weight 143.02 g/mol. IUPAC: 2-methyl-5-oxo-4H-1,3-oxazole-4-carboxylic acid.
Chemical Property Profile of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid
Property Insights of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid. The TPSA of 76.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid. Following Lipinski's Rule of Five, 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 5 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 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid?
The CAS number of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid is 906728-33-4.
What is the molecular formula of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid?
The molecular formula of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid is C5H5NO4.
What is the molecular weight of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid?
The molecular weight of 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid is 143.02 g/mol.
Where can I buy 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid?
You can request a quote for 2-Methyl-5-oxo-4,5-dihydrooxazole-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 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-5-oxo-4,5-dihydrooxazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.