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Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate
TL;DR: Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 302952-68-7) is a chemical compound with molecular formula C23H24O6 and molecular weight 396.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate
Also Known As: AF-399/14183217, ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate, ethyl {[3-(4-tert-butylphenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetate, ethyl 2-{3-[4-(tert-butyl)phenoxy]-4-oxochromen-7-yloxy}acetate, ethyl 2-((3-(4-(tert-butyl)phenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate
| Molecular Formula | C23H24O6 |
|---|---|
| Molecular Weight | 396.16 g/mol |
| LogP | 4.8247 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 396.1573 |
| Heavy Atoms | 29 |
| Complexity | 1057.4036 |
Chemical Identifiers
| CAS Number | 302952-68-7 |
|---|---|
| SMILES | CCOC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=C(C=C3)C(C)(C)C |
Product Overview
Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 302952-68-7), with molecular formula C23H24O6 and molecular weight 396.16 g/mol. IUPAC: ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate
Property Insights of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate
The XLogP value of 4.8247 indicates that Ethyl 2-[3-(4-tert-butylphenoxy)-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-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate. Following Lipinski's Rule of Five, Ethyl 2-[3-(4-tert-butylphenoxy)-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-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The CAS number of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate is 302952-68-7.
What is the molecular formula of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular formula of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate is C23H24O6.
What is the molecular weight of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular weight of Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate is 396.16 g/mol.
Where can I buy Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate?
You can request a quote for Ethyl 2-[3-(4-tert-butylphenoxy)-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-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[3-(4-tert-butylphenoxy)-4-oxochromen-7-yl]oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.