Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate
TL;DR: Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate (CAS 848918-95-6) is a chemical compound with molecular formula C25H18Cl2O5 and molecular weight 468.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(2Z)-2-[(2,6-dichlorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]-2-phenylacetate
Also Known As: Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate, (Z)-ethyl 2-((2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydrobenzofuran-6-yl)oxy)-2-phenylacetate, ethyl {[(2Z)-2-(2,6-dichlorobenzylidene)-3-oxo-2,3-dihydro-1-benzofuran-6-yl]oxy}(phenyl)acetate, ethyl 2-[[(2Z)-2-[(2,6-dichlorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]-2-phenylacetate, ethyl 2-{2-[(2,6-dichlorophenyl)methylene]-3-oxobenzo[3,4-b]furan-6-yloxy}-2-p henylacetate
| Molecular Formula | C25H18Cl2O5 |
|---|---|
| Molecular Weight | 468.05 g/mol |
| LogP | 6.2928 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 468.05313 |
| Heavy Atoms | 32 |
| Complexity | 1183.9591 |
Chemical Identifiers
| CAS Number | 848918-95-6 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC=CC=C1)OC2=CC3=C(C=C2)C(=O)/C(=C/C4=C(C=CC=C4Cl)Cl)/O3 |
Product Overview
Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate (CAS 848918-95-6), with molecular formula C25H18Cl2O5 and molecular weight 468.05 g/mol. IUPAC: ethyl 2-[[(2Z)-2-[(2,6-dichlorophenyl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]-2-phenylacetate.
Chemical Property Profile of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate
Property Insights of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate
The XLogP value of 6.2928 indicates that Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate. Following Lipinski's Rule of Five, Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate?
The CAS number of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate is 848918-95-6.
What is the molecular formula of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate?
The molecular formula of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate is C25H18Cl2O5.
What is the molecular weight of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate?
The molecular weight of Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate is 468.05 g/mol.
Where can I buy Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate?
You can request a quote for Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[2-[(2,6-dichlorophenyl)methylidene]-3-oxo-benzofuran-6-yl]oxy-2-phenyl-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.