O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate
TL;DR: O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate (CAS 63019-22-7) is a chemical compound with molecular formula C14H12BrCl2O2PS and molecular weight 423.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromo-2,5-dichlorophenoxy)-ethoxy-phenyl-sulfanylidene-λ5-phosphane
Also Known As: Ethyl Phosvel, Velsicol fcs-303, MAGNESIUM SULFATE, O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate, Phosphonothioic acid, phenyl-, O-(4-bromo-2,5-dichlorophenyl) O-ethyl ester
| Molecular Formula | C14H12BrCl2O2PS |
|---|---|
| Molecular Weight | 423.89 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.88562 |
| Heavy Atoms | 21 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 63019-22-7 |
|---|---|
| SMILES | CCOP(=S)(C1=CC=CC=C1)OC2=CC(=C(C=C2Cl)Br)Cl |
| InChIKey | ZEWUWNVXERZVIT-UHFFFAOYSA-N |
Product Overview
O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate (CAS 63019-22-7), with molecular formula C14H12BrCl2O2PS and molecular weight 423.89 g/mol. IUPAC: (4-bromo-2,5-dichlorophenoxy)-ethoxy-phenyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate
Property Insights of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate
The XLogP value of 6.7 indicates that O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate 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 O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate?
The CAS number of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate is 63019-22-7.
What is the molecular formula of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate?
The molecular formula of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate is C14H12BrCl2O2PS.
What is the molecular weight of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate?
The molecular weight of O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate is 423.89 g/mol.
Where can I buy O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate?
You can request a quote for O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for O-(4-Bromo-2,5-dichlorophenyl) O-ethyl phenylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.