Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester
TL;DR: Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester (CAS 2591-66-4) is a chemical compound with molecular formula C7H7Cl3NO2PS and molecular weight 304.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[amino(methoxy)phosphinothioyl]oxy-2,4,5-trichlorobenzene
Also Known As: Dow ET-15, OMS 3, Dow ET15, ENT 23,285, ET15
| Molecular Formula | C7H7Cl3NO2PS |
|---|---|
| Molecular Weight | 304.90 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 76.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.90005 |
| Heavy Atoms | 15 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 2591-66-4 |
|---|---|
| SMILES | COP(=S)(N)OC1=CC(=C(C=C1Cl)Cl)Cl |
| InChIKey | WRWBHVIYUCQSIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester (CAS 2591-66-4), with molecular formula C7H7Cl3NO2PS and molecular weight 304.90 g/mol. IUPAC: 1-[amino(methoxy)phosphinothioyl]oxy-2,4,5-trichlorobenzene.
Chemical Property Profile of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester
Property Insights of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester
The XLogP value of 4.3 indicates that Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester. Following Lipinski's Rule of Five, Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester has 1 hydrogen bond donor(s) and 4 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 Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester?
The CAS number of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester is 2591-66-4.
What is the molecular formula of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester?
The molecular formula of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester is C7H7Cl3NO2PS.
What is the molecular weight of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester?
The molecular weight of Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester is 304.90 g/mol.
Where can I buy Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester?
You can request a quote for Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphoramidothioic acid, O-methyl O-(2,4,5-trichlorophenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.