Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate
TL;DR: Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate (CAS 428847-31-8) is a chemical compound with molecular formula C11H11BrO5 and molecular weight 301.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(5-bromo-4-formyl-2-methoxyphenoxy)acetate
Also Known As: methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate, methyl 2-(5-bromo-4-formyl-2-methoxyphenoxy)acetate, AB00110097-01, methyl 2-(5-bromo-4-formyl-2-methoxy-phenoxy)acetate, Acetic acid, 2-(5-bromo-4-formyl-2-methoxyphenoxy)-, methyl ester
| Molecular Formula | C11H11BrO5 |
|---|---|
| Molecular Weight | 301.98 g/mol |
| LogP | 1.822 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 301.979 |
| Heavy Atoms | 17 |
| Complexity | 430.1151 |
Chemical Identifiers
| CAS Number | 428847-31-8 |
|---|---|
| SMILES | COC1=C(C=C(C(=C1)C=O)Br)OCC(=O)OC |
Product Overview
Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate (CAS 428847-31-8), with molecular formula C11H11BrO5 and molecular weight 301.98 g/mol. IUPAC: methyl 2-(5-bromo-4-formyl-2-methoxyphenoxy)acetate.
Chemical Property Profile of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate
Property Insights of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate
The XLogP value of 1.822 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate. Following Lipinski's Rule of Five, Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate has 0 hydrogen bond donor(s) and 5 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 (5-bromo-4-formyl-2-methoxyphenoxy)acetate?
The CAS number of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate is 428847-31-8.
What is the molecular formula of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate?
The molecular formula of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate is C11H11BrO5.
What is the molecular weight of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate?
The molecular weight of Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate is 301.98 g/mol.
Where can I buy Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate?
You can request a quote for Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (5-bromo-4-formyl-2-methoxyphenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.