ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate
TL;DR: ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate (CAS 844648-94-8) is a chemical compound with molecular formula C26H20Cl2O6 and molecular weight 498.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[7-[(3,4-dichlorophenyl)methoxy]-2-methyl-4-oxochromen-3-yl]oxybenzoate
Also Known As: ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate, ethyl 4-({7-[(3,4-dichlorobenzyl)oxy]-2-methyl-4-oxo-4H-chromen-3-yl}oxy)benzoate, Ethyl 4-[7-[(3,4-dichlorophenyl)methoxy]-2-methyl-4-oxo-chromen-3-yl]oxybenzoate, ethyl 4-[7-[(3,4-dichlorophenyl)methoxy]-2-methyl-4-oxochromen-3-yl]oxybenzoate, ethyl 4-{7-[(3,4-dichlorophenyl)methoxy]-2-methyl-4-oxochromen-3-yloxy}benzoat e
| Molecular Formula | C26H20Cl2O6 |
|---|---|
| Molecular Weight | 498.06 g/mol |
| LogP | 6.95622 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 498.0637 |
| Heavy Atoms | 34 |
| Complexity | 1409.7349 |
Chemical Identifiers
| CAS Number | 844648-94-8 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC(=C(C=C4)Cl)Cl)C |
Product Overview
ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate (CAS 844648-94-8), with molecular formula C26H20Cl2O6 and molecular weight 498.06 g/mol. IUPAC: ethyl 4-[7-[(3,4-dichlorophenyl)methoxy]-2-methyl-4-oxochromen-3-yl]oxybenzoate.
Chemical Property Profile of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate
Property Insights of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate
The XLogP value of 6.95622 indicates that ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate 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 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate. Following Lipinski's Rule of Five, ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate 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 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The CAS number of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate is 844648-94-8.
What is the molecular formula of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The molecular formula of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate is C26H20Cl2O6.
What is the molecular weight of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate?
The molecular weight of ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate is 498.06 g/mol.
Where can I buy ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate?
You can request a quote for ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 4-((7-((3,4-dichlorobenzyl)oxy)-2-methyl-4-oxo-4H-chromen-3-yl)oxy)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.