methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate
TL;DR: methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate (CAS 303119-35-9) is a chemical compound with molecular formula C18H13BrO6 and molecular weight 403.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate
Also Known As: BAS 01911513, methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate, methyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yloxy]acetate, [3-(2-Bromo-phenoxy)-4-oxo-4H-chromen-7-yloxy]-acetic acid methyl ester, methyl {[3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl]oxy}acetate
| Molecular Formula | C18H13BrO6 |
|---|---|
| Molecular Weight | 403.99 g/mol |
| LogP | 3.8996 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 403.98956 |
| Heavy Atoms | 25 |
| Complexity | 978.7074 |
Chemical Identifiers
| CAS Number | 303119-35-9 |
|---|---|
| SMILES | COC(=O)COC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3Br |
Product Overview
methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate (CAS 303119-35-9), with molecular formula C18H13BrO6 and molecular weight 403.99 g/mol. IUPAC: methyl 2-[3-(2-bromophenoxy)-4-oxochromen-7-yl]oxyacetate.
Chemical Property Profile of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate
Property Insights of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate
The XLogP value of 3.8996 indicates that methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate 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 methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate. Following Lipinski's Rule of Five, methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate 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 methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate?
The CAS number of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate is 303119-35-9.
What is the molecular formula of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate?
The molecular formula of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate is C18H13BrO6.
What is the molecular weight of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate?
The molecular weight of methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate is 403.99 g/mol.
Where can I buy methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate?
You can request a quote for methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-((3-(2-bromophenoxy)-4-oxo-4H-chromen-7-yl)oxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.