Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate
TL;DR: Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate (CAS 893783-01-2) is a chemical compound with molecular formula C12H17NO4 and molecular weight 239.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate
Also Known As: ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate, ethyl 5-(hydroxycyclohexyl)isoxazole-3-carboxylate, J3.618.739E, Ethyl 5-(1-hydroxycyclohexyl)-3-isoxazolecarboxylate, Ethyl 5-(1-hydroxycyclohexyl)isoxazole-3-carboxylate
| Molecular Formula | C12H17NO4 |
|---|---|
| Molecular Weight | 239.12 g/mol |
| LogP | 2.003 |
| Topological Polar Surface Area | 72.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.11575 |
| Heavy Atoms | 17 |
| Complexity | 392.9648 |
Chemical Identifiers
| CAS Number | 893783-01-2 |
|---|---|
| SMILES | CCOC(=O)C1=NOC(=C1)C2(CCCCC2)O |
Product Overview
Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate (CAS 893783-01-2), with molecular formula C12H17NO4 and molecular weight 239.12 g/mol. IUPAC: ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate.
Chemical Property Profile of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate
Property Insights of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate
The XLogP value of 2.003 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate. The TPSA of 72.56 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate 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 Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate?
The CAS number of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate is 893783-01-2.
What is the molecular formula of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate?
The molecular formula of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate is C12H17NO4.
What is the molecular weight of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate?
The molecular weight of Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate is 239.12 g/mol.
Where can I buy Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate?
You can request a quote for Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-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-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-(1-hydroxycyclohexyl)-1,2-oxazole-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.