O-Ethyl S-propyl P-methylphosphonothioate
TL;DR: O-Ethyl S-propyl P-methylphosphonothioate (CAS 13088-83-0) is a chemical compound with molecular formula C6H15O2PS and molecular weight 182.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[ethoxy(methyl)phosphoryl]sulfanylpropane
Also Known As: O-Ethyl S-propyl methylphosphonothioate, O-Ethyl S-propyl methylthiophosphonate, 1-[ethoxy(methyl)phosphoryl]sulfanylpropane, (R)-O-Ethyl S-propyl methylphosphonothioate, (+)-Ethyl S-propyl methylphosphonothioate
| Molecular Formula | C6H15O2PS |
|---|---|
| Molecular Weight | 182.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 182.05304 |
| Heavy Atoms | 10 |
| Complexity | 127.0 |
Chemical Identifiers
| CAS Number | 13088-83-0 |
|---|---|
| SMILES | CCCSP(=O)(C)OCC |
| InChIKey | DJHXPMPGUPBOKX-UHFFFAOYSA-N |
Product Overview
O-Ethyl S-propyl P-methylphosphonothioate (CAS 13088-83-0), with molecular formula C6H15O2PS and molecular weight 182.05 g/mol. IUPAC: 1-[ethoxy(methyl)phosphoryl]sulfanylpropane.
Chemical Property Profile of O-Ethyl S-propyl P-methylphosphonothioate
Property Insights of O-Ethyl S-propyl P-methylphosphonothioate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Ethyl S-propyl P-methylphosphonothioate. With a topological polar surface area (TPSA) of 51.6 Ų, O-Ethyl S-propyl P-methylphosphonothioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Ethyl S-propyl P-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-Ethyl S-propyl P-methylphosphonothioate?
The CAS number of O-Ethyl S-propyl P-methylphosphonothioate is 13088-83-0.
What is the molecular formula of O-Ethyl S-propyl P-methylphosphonothioate?
The molecular formula of O-Ethyl S-propyl P-methylphosphonothioate is C6H15O2PS.
What is the molecular weight of O-Ethyl S-propyl P-methylphosphonothioate?
The molecular weight of O-Ethyl S-propyl P-methylphosphonothioate is 182.05 g/mol.
Where can I buy O-Ethyl S-propyl P-methylphosphonothioate?
You can request a quote for O-Ethyl S-propyl P-methylphosphonothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O-Ethyl S-propyl P-methylphosphonothioate?
Yes, KEHONG BIO provides custom synthesis services for O-Ethyl S-propyl P-methylphosphonothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.