2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
TL;DR: 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate (CAS 7428-64-0) is a chemical compound with molecular formula C12H16Cl3O5P and molecular weight 375.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
Also Known As: 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate, Ethyl-beta-chloroethyl phosphate de dichloro-2,4-phenoxyethyle [French], Ethyl-beta-chloroethyl phosphate de dichloro-2,4-phenoxyethyle, Phosphoric acid, 2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl ester, RefChem:1062849
| Molecular Formula | C12H16Cl3O5P |
|---|---|
| Molecular Weight | 375.98 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 375.9801 |
| Heavy Atoms | 21 |
| Complexity | 334.0 |
Chemical Identifiers
| CAS Number | 7428-64-0 |
|---|---|
| SMILES | CCOP(=O)(OCCOC1=C(C=C(C=C1)Cl)Cl)OCCCl |
| InChIKey | CBXNLAMXWMNSQV-UHFFFAOYSA-N |
Product Overview
2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate (CAS 7428-64-0), with molecular formula C12H16Cl3O5P and molecular weight 375.98 g/mol. IUPAC: 2-chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate.
Chemical Property Profile of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
Property Insights of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate
The XLogP value of 3.4 indicates that 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate 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-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate?
The CAS number of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate is 7428-64-0.
What is the molecular formula of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate?
The molecular formula of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate is C12H16Cl3O5P.
What is the molecular weight of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate?
The molecular weight of 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate is 375.98 g/mol.
Where can I buy 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate?
You can request a quote for 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl 2-(2,4-dichlorophenoxy)ethyl ethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.