Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate
TL;DR: Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate (CAS 314745-69-2) is a chemical compound with molecular formula C25H15F5O6 and molecular weight 506.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-2-phenyl-1-benzofuran-3-carboxylate
Also Known As: ChemDiv1_009567, ethyl 5-(2-(perfluorophenoxy)acetoxy)-2-phenylbenzofuran-3-carboxylate, 3-(ethoxycarbonyl)-2-phenylbenzo[b]furan-5-yl 2-(2,3,4,5,6-pentafluorophenoxy) acetate, ethyl 5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-2-phenyl-1-benzofuran-3-carboxylate, ethyl 5-{[(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate
| Molecular Formula | C25H15F5O6 |
|---|---|
| Molecular Weight | 506.08 g/mol |
| LogP | 5.9564 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 506.0789 |
| Heavy Atoms | 36 |
| Complexity | 1436.3191 |
Chemical Identifiers
| CAS Number | 314745-69-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(OC2=C1C=C(C=C2)OC(=O)COC3=C(C(=C(C(=C3F)F)F)F)F)C4=CC=CC=C4 |
Product Overview
Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate (CAS 314745-69-2), with molecular formula C25H15F5O6 and molecular weight 506.08 g/mol. IUPAC: ethyl 5-[2-(2,3,4,5,6-pentafluorophenoxy)acetyl]oxy-2-phenyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate
Property Insights of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate
The XLogP value of 5.9564 indicates that Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-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 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate. Following Lipinski's Rule of Five, Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-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 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate?
The CAS number of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate is 314745-69-2.
What is the molecular formula of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate?
The molecular formula of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate is C25H15F5O6.
What is the molecular weight of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate?
The molecular weight of Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate is 506.08 g/mol.
Where can I buy Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate?
You can request a quote for Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-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 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5-{[(pentafluorophenoxy)acetyl]oxy}-2-phenyl-1-benzofuran-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.