3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate
TL;DR: 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate (CAS 302952-86-9) is a chemical compound with molecular formula C24H14BrF3O6 and molecular weight 533.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate
Also Known As: 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate, 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl 3-bromobenzoate, [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate
| Molecular Formula | C24H14BrF3O6 |
|---|---|
| Molecular Weight | 533.99 g/mol |
| LogP | 6.5944 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 533.9926 |
| Heavy Atoms | 34 |
| Complexity | 1427.8357 |
Chemical Identifiers
| CAS Number | 302952-86-9 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC(=CC=C4)Br)C(F)(F)F |
Product Overview
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate (CAS 302952-86-9), with molecular formula C24H14BrF3O6 and molecular weight 533.99 g/mol. IUPAC: [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 3-bromobenzoate.
Chemical Property Profile of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate
Property Insights of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate
The XLogP value of 6.5944 indicates that 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate 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 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate. Following Lipinski's Rule of Five, 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate 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 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate?
The CAS number of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate is 302952-86-9.
What is the molecular formula of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate?
The molecular formula of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate is C24H14BrF3O6.
What is the molecular weight of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate?
The molecular weight of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate is 533.99 g/mol.
Where can I buy 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate?
You can request a quote for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 3-bromobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.