![Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate structure](/static/products/848/848728-28-9.png)
Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate
TL;DR: Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 848728-28-9) is a chemical compound with molecular formula C21H19BrO6 and molecular weight 446.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate
Also Known As: AB00952823-02, F3385-0976, tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate, tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yloxy]acetate, tert-butyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate
| Molecular Formula | C21H19BrO6 |
|---|---|
| Molecular Weight | 446.04 g/mol |
| LogP | 5.0683 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 446.0365 |
| Heavy Atoms | 28 |
| Complexity | 1064.4143 |
Chemical Identifiers
| CAS Number | 848728-28-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br |
Product Overview
Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate (CAS 848728-28-9), with molecular formula C21H19BrO6 and molecular weight 446.04 g/mol. IUPAC: tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate
Property Insights of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate
The XLogP value of 5.0683 indicates that Tert-butyl 2-[3-(2-bromophenoxy)-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 Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate. Following Lipinski's Rule of Five, Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate 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 Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate?
The CAS number of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate is 848728-28-9.
What is the molecular formula of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular formula of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate is C21H19BrO6.
What is the molecular weight of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate?
The molecular weight of Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate is 446.04 g/mol.
Where can I buy Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate?
You can request a quote for Tert-butyl 2-[3-(2-bromophenoxy)-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 Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.