Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester
TL;DR: Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester (CAS 946-04-3) is a chemical compound with molecular formula C7H6Cl3O2PS and molecular weight 289.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
chloro-(2,4-dichlorophenoxy)-methoxy-sulfanylidene-λ5-phosphane
Also Known As: chloro-(2,4-dichlorophenoxy)-methoxy-sulfanylidene-, O-2,4-dichlorophenyl O-methyl chlorophosphonothioate, o-(2,4-Dichlorophenyl) o-methyl chloridothiophosphate, Chloridothiophosphoric acid O-(2,4-dichlorophenyl)O-methyl ester, o-(2,4-Dichlorophenyl) o-methyl chloridothiophosphate #
| Molecular Formula | C7H6Cl3O2PS |
|---|---|
| Molecular Weight | 289.89 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.88916 |
| Heavy Atoms | 14 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 946-04-3 |
|---|---|
| SMILES | COP(=S)(OC1=C(C=C(C=C1)Cl)Cl)Cl |
| InChIKey | JDAHQXMPRJJIQA-UHFFFAOYSA-N |
Product Overview
Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester (CAS 946-04-3), with molecular formula C7H6Cl3O2PS and molecular weight 289.89 g/mol. IUPAC: chloro-(2,4-dichlorophenoxy)-methoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester
Property Insights of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester
The XLogP value of 4.5 indicates that Phosphorochloridothioic acid, O-(2,4-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 50.6 Ų, Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorochloridothioic acid, O-(2,4-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 Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester?
The CAS number of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester is 946-04-3.
What is the molecular formula of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester?
The molecular formula of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester is C7H6Cl3O2PS.
What is the molecular weight of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester?
The molecular weight of Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester is 289.89 g/mol.
Where can I buy Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester?
You can request a quote for Phosphorochloridothioic acid, O-(2,4-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 Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorochloridothioic acid, O-(2,4-dichlorophenyl) O-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.