ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate
TL;DR: ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate (CAS 488137-36-6) is a chemical compound with molecular formula C25H27BrO6 and molecular weight 502.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate
Also Known As: ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate, ethyl 2-[2-(tert-butyl)-6-bromo-3-(ethoxycarbonyl)benzo[b]furan-5-yloxy]-2-phe nylacetate, ethyl 6-bromo-2-(tert-butyl)-5-(2-ethoxy-2-oxo-1-phenylethoxy)benzofuran-3-carboxylate, Ethyl 6-bromo-5-(ethoxycarbonyl-phenyl-methoxy)-2-tert-butyl-benzofuran-3-carboxylate
| Molecular Formula | C25H27BrO6 |
|---|---|
| Molecular Weight | 502.10 g/mol |
| LogP | 6.3527 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 502.0991 |
| Heavy Atoms | 32 |
| Complexity | 1110.9028 |
Chemical Identifiers
| CAS Number | 488137-36-6 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=CC(=C(C=C21)OC(C3=CC=CC=C3)C(=O)OCC)Br)C(C)(C)C |
Product Overview
ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate (CAS 488137-36-6), with molecular formula C25H27BrO6 and molecular weight 502.10 g/mol. IUPAC: ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate.
Chemical Property Profile of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate
Property Insights of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate
The XLogP value of 6.3527 indicates that ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate. Following Lipinski's Rule of Five, ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate?
The CAS number of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate is 488137-36-6.
What is the molecular formula of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate?
The molecular formula of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate is C25H27BrO6.
What is the molecular weight of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate?
The molecular weight of ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate is 502.10 g/mol.
Where can I buy ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate?
You can request a quote for ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-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 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 6-bromo-2-tert-butyl-5-(2-ethoxy-2-oxo-1-phenylethoxy)-1-benzofuran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.