Methyl 3-hydroxyisoxazole-5-carboxylate
TL;DR: Methyl 3-hydroxyisoxazole-5-carboxylate (CAS 10068-07-2) 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.
methyl 3-oxo-1,2-oxazole-5-carboxylate
Also Known As: Methyl 3-hydroxyisoxazole-5-carboxylate, Methyl 3-hydroxy-5-isoxazolecarboxylate, methyl 3-oxo-1,2-oxazole-5-carboxylate, methyl 3-hydroxy-1,2-oxazole-5-carboxylate, 5-Isoxazolecarboxylic acid, 2,3-dihydro-3-oxo-, methyl ester
| Molecular Formula | C5H5NO4 |
|---|---|
| Molecular Weight | 143.02 g/mol |
| LogP | -0.2455 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 143.02185 |
| Heavy Atoms | 10 |
| Complexity | 283.8381 |
Chemical Identifiers
| CAS Number | 10068-07-2 |
|---|---|
| SMILES | COC(=O)C1=CC(=O)NO1 |
Product Overview
Methyl 3-hydroxyisoxazole-5-carboxylate (CAS 10068-07-2), with molecular formula C5H5NO4 and molecular weight 143.02 g/mol. IUPAC: methyl 3-oxo-1,2-oxazole-5-carboxylate.
Chemical Property Profile of Methyl 3-hydroxyisoxazole-5-carboxylate
Property Insights of Methyl 3-hydroxyisoxazole-5-carboxylate
The XLogP value of -0.2455 indicates that Methyl 3-hydroxyisoxazole-5-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 72.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-hydroxyisoxazole-5-carboxylate. Following Lipinski's Rule of Five, Methyl 3-hydroxyisoxazole-5-carboxylate has 1 hydrogen bond donor(s) and 4 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 Methyl 3-hydroxyisoxazole-5-carboxylate?
The CAS number of Methyl 3-hydroxyisoxazole-5-carboxylate is 10068-07-2.
What is the molecular formula of Methyl 3-hydroxyisoxazole-5-carboxylate?
The molecular formula of Methyl 3-hydroxyisoxazole-5-carboxylate is C5H5NO4.
What is the molecular weight of Methyl 3-hydroxyisoxazole-5-carboxylate?
The molecular weight of Methyl 3-hydroxyisoxazole-5-carboxylate is 143.02 g/mol.
Where can I buy Methyl 3-hydroxyisoxazole-5-carboxylate?
You can request a quote for Methyl 3-hydroxyisoxazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-hydroxyisoxazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-hydroxyisoxazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.