Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate
TL;DR: Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate (CAS 23429-04-1) is a chemical compound with molecular formula C9H13NO4 and molecular weight 199.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate
Also Known As: Pyridoxine Impurity 17, Vitamin B6 Impurity 94, Ethyl 5-ethoxy-4-methyloxazole-2-carboxylate, Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate, 2-Oxazolecarboxylic acid, 5-ethoxy-4-methyl-, ethyl ester
| Molecular Formula | C9H13NO4 |
|---|---|
| Molecular Weight | 199.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.08446 |
| Heavy Atoms | 14 |
| Complexity | 197.0 |
Chemical Identifiers
| CAS Number | 23429-04-1 |
|---|---|
| SMILES | CCOC1=C(N=C(O1)C(=O)OCC)C |
| InChIKey | PQRKGFMROBZFIM-UHFFFAOYSA-N |
Product Overview
Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate (CAS 23429-04-1), with molecular formula C9H13NO4 and molecular weight 199.08 g/mol. IUPAC: ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate.
Chemical Property Profile of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate
Property Insights of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate 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 Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate?
The CAS number of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate is 23429-04-1.
What is the molecular formula of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate?
The molecular formula of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate is C9H13NO4.
What is the molecular weight of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate?
The molecular weight of Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate is 199.08 g/mol.
Where can I buy Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate?
You can request a quote for Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-ethoxy-4-methyl-1,3-oxazole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.