5-Isoxazolidinecarboxylic acid, methyl ester
TL;DR: 5-Isoxazolidinecarboxylic acid, methyl ester (CAS 15166-59-3) is a chemical compound with molecular formula C5H9NO3 and molecular weight 131.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1,2-oxazolidine-5-carboxylate
Also Known As: Methyl isoxazolidine-5-carboxylate, methyl 1,2-oxazolidine-5-carboxylate, 5-methoxycarbonylisoxazolidine, Methyl 5-isoxazolidinecarboxylate, 5-Isoxazolidinecarboxylic acid, methyl ester
| Molecular Formula | C5H9NO3 |
|---|---|
| Molecular Weight | 131.06 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 131.05824 |
| Heavy Atoms | 9 |
| Complexity | 115.0 |
Chemical Identifiers
| CAS Number | 15166-59-3 |
|---|---|
| SMILES | COC(=O)C1CCNO1 |
| InChIKey | JMPINCVRAYMNFG-UHFFFAOYSA-N |
Product Overview
5-Isoxazolidinecarboxylic acid, methyl ester (CAS 15166-59-3), with molecular formula C5H9NO3 and molecular weight 131.06 g/mol. IUPAC: methyl 1,2-oxazolidine-5-carboxylate.
Chemical Property Profile of 5-Isoxazolidinecarboxylic acid, methyl ester
Property Insights of 5-Isoxazolidinecarboxylic acid, methyl ester
The XLogP value of -0.1 indicates that 5-Isoxazolidinecarboxylic acid, methyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 47.6 Ų, 5-Isoxazolidinecarboxylic acid, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isoxazolidinecarboxylic acid, methyl ester 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 5-Isoxazolidinecarboxylic acid, methyl ester?
The CAS number of 5-Isoxazolidinecarboxylic acid, methyl ester is 15166-59-3.
What is the molecular formula of 5-Isoxazolidinecarboxylic acid, methyl ester?
The molecular formula of 5-Isoxazolidinecarboxylic acid, methyl ester is C5H9NO3.
What is the molecular weight of 5-Isoxazolidinecarboxylic acid, methyl ester?
The molecular weight of 5-Isoxazolidinecarboxylic acid, methyl ester is 131.06 g/mol.
Where can I buy 5-Isoxazolidinecarboxylic acid, methyl ester?
You can request a quote for 5-Isoxazolidinecarboxylic acid, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isoxazolidinecarboxylic acid, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Isoxazolidinecarboxylic acid, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.