2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate
TL;DR: 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate (CAS 836662-18-1) is a chemical compound with molecular formula C12H13BrO5 and molecular weight 315.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-bromo-4-formyl-2-methoxyphenoxy)ethyl acetate
Also Known As: 2-(5-bromo-4-formyl-2-methoxyphenoxy)ethyl acetate, 2-(5-bromo-4-formyl-2-methoxy-phenoxy)ethyl acetate
| Molecular Formula | C12H13BrO5 |
|---|---|
| Molecular Weight | 315.99 g/mol |
| LogP | 2.2121 |
| Topological Polar Surface Area | 61.83 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 315.99463 |
| Heavy Atoms | 18 |
| Complexity | 444.33905 |
Chemical Identifiers
| CAS Number | 836662-18-1 |
|---|---|
| SMILES | CC(=O)OCCOC1=C(C=C(C(=C1)Br)C=O)OC |
Product Overview
2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate (CAS 836662-18-1), with molecular formula C12H13BrO5 and molecular weight 315.99 g/mol. IUPAC: 2-(5-bromo-4-formyl-2-methoxyphenoxy)ethyl acetate.
Chemical Property Profile of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate
Property Insights of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate
The XLogP value of 2.2121 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate. The TPSA of 61.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate. Following Lipinski's Rule of Five, 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl 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 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate?
The CAS number of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate is 836662-18-1.
What is the molecular formula of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate?
The molecular formula of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate is C12H13BrO5.
What is the molecular weight of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate?
The molecular weight of 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate is 315.99 g/mol.
Where can I buy 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate?
You can request a quote for 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Bromo-4-formyl-2-methoxyphenoxy)ethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.