5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester
TL;DR: 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester (CAS 28783-55-3) is a chemical compound with molecular formula C8H11NO4 and molecular weight 185.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethoxy-1,2-oxazole-4-carboxylate
Also Known As: 5-ethoxy-4-ethoxycarbonylisoxazole, ethyl 5-ethoxyisoxazole-4-carboxylate, ethyl 5-ethoxy-1,2-oxazole-4-carboxylate, 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester
| Molecular Formula | C8H11NO4 |
|---|---|
| Molecular Weight | 185.07 g/mol |
| LogP | 1.25 |
| Topological Polar Surface Area | 61.56 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.0688 |
| Heavy Atoms | 13 |
| Complexity | 281.42633 |
Chemical Identifiers
| CAS Number | 28783-55-3 |
|---|---|
| SMILES | CCOC1=C(C=NO1)C(=O)OCC |
Product Overview
5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester (CAS 28783-55-3), with molecular formula C8H11NO4 and molecular weight 185.07 g/mol. IUPAC: ethyl 5-ethoxy-1,2-oxazole-4-carboxylate.
Chemical Property Profile of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester
Property Insights of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester
The XLogP value of 1.25 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester. The TPSA of 61.56 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester. Following Lipinski's Rule of Five, 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester has 0 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 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester?
The CAS number of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester is 28783-55-3.
What is the molecular formula of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester?
The molecular formula of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester is C8H11NO4.
What is the molecular weight of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester?
The molecular weight of 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester is 185.07 g/mol.
Where can I buy 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester?
You can request a quote for 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethoxyisoxazol-4-carboxylic acid, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.