[2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate
TL;DR: [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate (CAS 64050-64-2) is a chemical compound with molecular formula C12H14Cl2FO4P and molecular weight 342.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate
Also Known As: Shell SD-9052, ENT 27,101, SD 9052, 2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl diethyl phosphate, [2-chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate
| Molecular Formula | C12H14Cl2FO4P |
|---|---|
| Molecular Weight | 342.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 341.99908 |
| Heavy Atoms | 20 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 64050-64-2 |
|---|---|
| SMILES | CCOP(=O)(OCC)OC(=CCl)C1=C(C=C(C=C1)Cl)F |
| InChIKey | GRQGQYJGKUWSJE-UHFFFAOYSA-N |
Product Overview
[2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate (CAS 64050-64-2), with molecular formula C12H14Cl2FO4P and molecular weight 342.00 g/mol. IUPAC: [2-chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate.
Chemical Property Profile of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate
Property Insights of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl 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-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate?
The CAS number of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate is 64050-64-2.
What is the molecular formula of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate?
The molecular formula of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate is C12H14Cl2FO4P.
What is the molecular weight of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate?
The molecular weight of [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate is 342.00 g/mol.
Where can I buy [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate?
You can request a quote for [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for [2-Chloro-1-(4-chloro-2-fluorophenyl)ethenyl] diethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.