Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester
TL;DR: Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester (CAS 71432-22-9) is a chemical compound with molecular formula C14H13Cl2O2PS and molecular weight 345.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dichlorophenoxy)-ethoxy-phenyl-sulfanylidene-λ5-phosphane
Also Known As: O-(2,5-Dichlorophenyl) O-ethyl phenyl thiophosphonate, Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester, (2,5-dichlorophenoxy)-ethoxy-phenyl-sulfanylidene-, O-(2,5-Dichlorophenyl) O-ethyl phenylphosphonothioate, RefChem:1095277
| Molecular Formula | C14H13Cl2O2PS |
|---|---|
| Molecular Weight | 345.98 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.9751 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 71432-22-9 |
|---|---|
| SMILES | CCOP(=S)(C1=CC=CC=C1)OC2=C(C=CC(=C2)Cl)Cl |
| InChIKey | CARRPEGWSXLPNK-UHFFFAOYSA-N |
Product Overview
Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester (CAS 71432-22-9), with molecular formula C14H13Cl2O2PS and molecular weight 345.98 g/mol. IUPAC: (2,5-dichlorophenoxy)-ethoxy-phenyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester
Property Insights of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester
The XLogP value of 5.8 indicates that Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester 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 Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester?
The CAS number of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester is 71432-22-9.
What is the molecular formula of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester?
The molecular formula of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester is C14H13Cl2O2PS.
What is the molecular weight of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester?
The molecular weight of Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester is 345.98 g/mol.
Where can I buy Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester?
You can request a quote for Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, phenyl-, O-(2,5-dichlorophenyl) O-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.