4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate
TL;DR: 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate (CAS 590380-53-3) is a chemical compound with molecular formula C15H12BrClO4 and molecular weight 369.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromo-2-chlorophenyl) 2-(4-methoxyphenoxy)acetate
Also Known As: 4-bromo-2-chlorophenyl (4-methoxyphenoxy)acetate, (4-bromo-2-chlorophenyl) 2-(4-methoxyphenoxy)acetate, AN-329/42173584, 4-bromo-2-chlorophenyl 2-(4-methoxyphenoxy)acetate
| Molecular Formula | C15H12BrClO4 |
|---|---|
| Molecular Weight | 369.96 g/mol |
| LogP | 4.0955 |
| Topological Polar Surface Area | 44.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.96075 |
| Heavy Atoms | 21 |
| Complexity | 628.0708 |
Chemical Identifiers
| CAS Number | 590380-53-3 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OCC(=O)OC2=C(C=C(C=C2)Br)Cl |
Product Overview
4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate (CAS 590380-53-3), with molecular formula C15H12BrClO4 and molecular weight 369.96 g/mol. IUPAC: (4-bromo-2-chlorophenyl) 2-(4-methoxyphenoxy)acetate.
Chemical Property Profile of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate
Property Insights of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate
The XLogP value of 4.0955 indicates that 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.76 Ų, 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate has 0 hydrogen bond donor(s) and 4 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 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate?
The CAS number of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate is 590380-53-3.
What is the molecular formula of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate?
The molecular formula of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate is C15H12BrClO4.
What is the molecular weight of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate?
The molecular weight of 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate is 369.96 g/mol.
Where can I buy 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate?
You can request a quote for 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-chlorophenyl (4-methoxyphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.