o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate
TL;DR: o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate (CAS 6293-55-6) is a chemical compound with molecular formula C8H9Cl2O2PS and molecular weight 269.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6-dichlorophenoxy)-methoxy-methyl-sulfanylidene-λ5-phosphane
Also Known As: o-(2,6-dichlorophenyl) o-methyl methylphosphonothioate, (2,6-dichlorophenoxy)-methoxy-methyl-sulfanylidene-, (2,6-dichlorophenoxy)-methoxy-methyl-sulfanylidene-phosphorane, Phosphonothioic acid, methyl-, O-(2,6-dichlorophenyl) O-methyl ester
| Molecular Formula | C8H9Cl2O2PS |
|---|---|
| Molecular Weight | 269.94 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.9438 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 6293-55-6 |
|---|---|
| SMILES | COP(=S)(C)OC1=C(C=CC=C1Cl)Cl |
| InChIKey | JXPLIXDQUAGZER-UHFFFAOYSA-N |
Product Overview
o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate (CAS 6293-55-6), with molecular formula C8H9Cl2O2PS and molecular weight 269.94 g/mol. IUPAC: (2,6-dichlorophenoxy)-methoxy-methyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate
Property Insights of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate
The XLogP value of 4.3 indicates that o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate 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-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate 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 o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate?
The CAS number of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate is 6293-55-6.
What is the molecular formula of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate?
The molecular formula of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate is C8H9Cl2O2PS.
What is the molecular weight of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate?
The molecular weight of o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate is 269.94 g/mol.
Where can I buy o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate?
You can request a quote for o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for o-(2,6-Dichlorophenyl) o-methyl methylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.