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Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
TL;DR: Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 307535-17-7) is a chemical compound with molecular formula C21H20O6 and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
Also Known As: AF-399/15033252, ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate, ethyl {[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetate, ethyl 2-{[3-(3,5-dimethylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetate, ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yloxy]acetate
| Molecular Formula | C21H20O6 |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 4.14404 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 368.12598 |
| Heavy Atoms | 27 |
| Complexity | 1014.26154 |
Chemical Identifiers
| CAS Number | 307535-17-7 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC(=CC(=C3)C)C |
Product Overview
Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 307535-17-7), with molecular formula C21H20O6 and molecular weight 368.13 g/mol. IUPAC: ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
Property Insights of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate
The XLogP value of 4.14404 indicates that Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate 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 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate has 0 hydrogen bond donor(s) and 6 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 Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The CAS number of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate is 307535-17-7.
What is the molecular formula of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular formula of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate is C21H20O6.
What is the molecular weight of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular weight of Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate is 368.13 g/mol.
Where can I buy Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate?
You can request a quote for Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.