2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate
TL;DR: 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate (CAS 442563-91-9) is a chemical compound with molecular formula C22H21ClO7 and molecular weight 432.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxyethyl 2-[3-(2-chlorophenoxy)-4-oxochromen-7-yl]oxypropanoate
Also Known As: ChemDiv1_010511, 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate, AS-871/41245393, 2-ethoxyethyl 2-[3-(2-chlorophenoxy)-4-oxochromen-7-yl]oxypropanoate, 2-ethoxyethyl 2-((3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl)oxy)propanoate
| Molecular Formula | C22H21ClO7 |
|---|---|
| Molecular Weight | 432.10 g/mol |
| LogP | 4.5857 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 432.0976 |
| Heavy Atoms | 30 |
| Complexity | 1076.5143 |
Chemical Identifiers
| CAS Number | 442563-91-9 |
|---|---|
| SMILES | CCOCCOC(=O)C(C)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Cl |
Product Overview
2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate (CAS 442563-91-9), with molecular formula C22H21ClO7 and molecular weight 432.10 g/mol. IUPAC: 2-ethoxyethyl 2-[3-(2-chlorophenoxy)-4-oxochromen-7-yl]oxypropanoate.
Chemical Property Profile of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate
Property Insights of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate
The XLogP value of 4.5857 indicates that 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate. Following Lipinski's Rule of Five, 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate has 0 hydrogen bond donor(s) and 7 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 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate?
The CAS number of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate is 442563-91-9.
What is the molecular formula of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate?
The molecular formula of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate is C22H21ClO7.
What is the molecular weight of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate?
The molecular weight of 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate is 432.10 g/mol.
Where can I buy 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate?
You can request a quote for 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate?
Yes, KEHONG BIO provides custom synthesis services for 2-ethoxyethyl 2-{[3-(2-chlorophenoxy)-4-oxo-4H-chromen-7-yl]oxy}propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.