2-Ethylhexyl (2,4-dichlorophenoxy)acetate
TL;DR: 2-Ethylhexyl (2,4-dichlorophenoxy)acetate (CAS 1928-43-4) is a chemical compound with molecular formula C16H22Cl2O3 and molecular weight 332.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylhexyl 2-(2,4-dichlorophenoxy)acetate
Also Known As: 2,4-D 2-Ethylhexyl ester, Mixture Name, 2,4-D-2-ethylhexyl, Caswell No. 315AS, 2,4-D-etexyl
| Molecular Formula | C16H22Cl2O3 |
|---|---|
| Molecular Weight | 332.09 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 332.0946 |
| Heavy Atoms | 21 |
| Complexity | 299.0 |
| Melting Point | <-37 °C |
| Boiling Point | >300 °C (decomp) |
| Density | 1.148 at 20 °C |
| Solubility | In water, 0.086 mg/L at 25 °C |
| Flash Point | 171 °C (Cleveland open cup) |
| Vapor Pressure | 0.000359 [mmHg] |
Chemical Identifiers
| CAS Number | 1928-43-4 |
|---|---|
| SMILES | CCCCC(CC)COC(=O)COC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | QZSFJRIWRPJUOH-UHFFFAOYSA-N |
Product Overview
2-Ethylhexyl (2,4-dichlorophenoxy)acetate (CAS 1928-43-4), with molecular formula C16H22Cl2O3 and molecular weight 332.09 g/mol. IUPAC: 2-ethylhexyl 2-(2,4-dichlorophenoxy)acetate.
Chemical Property Profile of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate
Property Insights of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate
The XLogP value of 6.3 indicates that 2-Ethylhexyl (2,4-dichlorophenoxy)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 2-Ethylhexyl (2,4-dichlorophenoxy)acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethylhexyl (2,4-dichlorophenoxy)acetate has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate?
The CAS number of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate is 1928-43-4.
What is the molecular formula of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate?
The molecular formula of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate is C16H22Cl2O3.
What is the molecular weight of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate?
The molecular weight of 2-Ethylhexyl (2,4-dichlorophenoxy)acetate is 332.09 g/mol.
Where can I buy 2-Ethylhexyl (2,4-dichlorophenoxy)acetate?
You can request a quote for 2-Ethylhexyl (2,4-dichlorophenoxy)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylhexyl (2,4-dichlorophenoxy)acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylhexyl (2,4-dichlorophenoxy)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.