Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester
TL;DR: Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester (CAS 2720-20-9) is a chemical compound with molecular formula C8H8BrCl2O2PS and molecular weight 347.85 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromo-2,5-dichlorophenoxy)-methoxy-methyl-sulfanylidene-λ5-phosphane
Also Known As: AI3-29098, Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester, (4-bromo-2,5-dichlorophenoxy)-methoxy-methyl-sulfanylidene-, O-(4-Bromo-2,5-dichlorophenyl) O-methyl methylphosphonothioate
| Molecular Formula | C8H8BrCl2O2PS |
|---|---|
| Molecular Weight | 347.85 g/mol |
| LogP | 4.7204 |
| Topological Polar Surface Area | 18.46 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 347.8543 |
| Heavy Atoms | 15 |
| Complexity | 427.34784 |
Chemical Identifiers
| CAS Number | 2720-20-9 |
|---|---|
| SMILES | COP(=S)(C)OC1=CC(=C(C=C1Cl)Br)Cl |
Product Overview
Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester (CAS 2720-20-9), with molecular formula C8H8BrCl2O2PS and molecular weight 347.85 g/mol. IUPAC: (4-bromo-2,5-dichlorophenoxy)-methoxy-methyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester
Property Insights of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester
The XLogP value of 4.7204 indicates that Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.46 Ų, Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester has 0 hydrogen bond donor(s) and 3 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 Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester?
The CAS number of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester is 2720-20-9.
What is the molecular formula of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester?
The molecular formula of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester is C8H8BrCl2O2PS.
What is the molecular weight of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester?
The molecular weight of Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester is 347.85 g/mol.
Where can I buy Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester?
You can request a quote for Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl 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, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, methyl-, O-(4-bromo-2,5-dichlorophenyl) O-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.