Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester
TL;DR: Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester (CAS 38528-24-4) is a chemical compound with molecular formula C11H16ClO3PS and molecular weight 294.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene
Also Known As: O-(4-Chlorophenyl) O-ethyl S-propylphosphorothioate, J1.838.077C, Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester, 4-chlorophenyl ethyl (propylsulfanyl)phosphonate, 1-chloro-4-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene
| Molecular Formula | C11H16ClO3PS |
|---|---|
| Molecular Weight | 294.02 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 60.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 294.02463 |
| Heavy Atoms | 17 |
| Complexity | 257.0 |
Chemical Identifiers
| CAS Number | 38528-24-4 |
|---|---|
| SMILES | CCCSP(=O)(OCC)OC1=CC=C(C=C1)Cl |
| InChIKey | ONFQRDXTWNAUFO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester (CAS 38528-24-4), with molecular formula C11H16ClO3PS and molecular weight 294.02 g/mol. IUPAC: 1-chloro-4-[ethoxy(propylsulfanyl)phosphoryl]oxybenzene.
Chemical Property Profile of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester
Property Insights of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester
The XLogP value of 4.0 indicates that Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester. Following Lipinski's Rule of Five, Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester has 0 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 Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester?
The CAS number of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester is 38528-24-4.
What is the molecular formula of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester?
The molecular formula of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester is C11H16ClO3PS.
What is the molecular weight of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester?
The molecular weight of Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester is 294.02 g/mol.
Where can I buy Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester?
You can request a quote for Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O-(4-chlorophenyl) O-ethyl S-propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.