ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate
TL;DR: ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate (CAS 302952-92-7) is a chemical compound with molecular formula C20H15F3O7 and molecular weight 424.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] carbonate
Also Known As: ChemDiv1_010259, BIM-0047156.P001, AF-399/14183241, ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate, ethyl [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] carbonate
| Molecular Formula | C20H15F3O7 |
|---|---|
| Molecular Weight | 424.08 g/mol |
| LogP | 5.148 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 424.077 |
| Heavy Atoms | 30 |
| Complexity | 1118.1787 |
Chemical Identifiers
| CAS Number | 302952-92-7 |
|---|---|
| SMILES | CCOC(=O)OC1=CC2=C(C=C1)C(=O)C(=C(O2)C(F)(F)F)OC3=CC=C(C=C3)OC |
Product Overview
ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate (CAS 302952-92-7), with molecular formula C20H15F3O7 and molecular weight 424.08 g/mol. IUPAC: ethyl [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] carbonate.
Chemical Property Profile of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate
Property Insights of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate
The XLogP value of 5.148 indicates that ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate 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 ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate. Following Lipinski's Rule of Five, ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate?
The CAS number of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate is 302952-92-7.
What is the molecular formula of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate?
The molecular formula of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate is C20H15F3O7.
What is the molecular weight of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate?
The molecular weight of ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate is 424.08 g/mol.
Where can I buy ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate?
You can request a quote for ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.