![[3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate structure](/static/products/5741/5741-69-5.webp)
[3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate
TL;DR: [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate (CAS 5741-69-5) is a chemical compound with molecular formula C20H28Cl2O5 and molecular weight 418.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[2-(2,4-dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate
Also Known As: [3-[2-(2,4-dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl]|[3-[2-(2,4-dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate|3-{[(2,4-Dichlorophenoxy)acetyl]oxy}-2,2,4-trimethylpentyl 2-methylpropanoate
| Molecular Formula | C20H28Cl2O5 |
|---|---|
| Molecular Weight | 418.13 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 418.13138 |
| Heavy Atoms | 27 |
| Complexity | 493.0 |
Chemical Identifiers
| CAS Number | 5741-69-5 |
|---|---|
| SMILES | CC(C)C(C(C)(C)COC(=O)C(C)C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | YLJSKVWGPBFKBU-UHFFFAOYSA-N |
Product Overview
[3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate (CAS 5741-69-5), with molecular formula C20H28Cl2O5 and molecular weight 418.13 g/mol. IUPAC: [3-[2-(2,4-dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate.
Chemical Property Profile of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate
Property Insights of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate
The XLogP value of 6.6 indicates that [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate. Following Lipinski's Rule of Five, [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate?
The CAS number of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate is 5741-69-5.
What is the molecular formula of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate?
The molecular formula of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate is C20H28Cl2O5.
What is the molecular weight of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate?
The molecular weight of [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate is 418.13 g/mol.
Where can I buy [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate?
You can request a quote for [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate?
Yes, KEHONG BIO provides custom synthesis services for [3-[2-(2,4-Dichlorophenoxy)acetyl]oxy-2,2,4-trimethylpentyl] 2-methylpropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.