Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester
TL;DR: Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester (CAS 53151-69-2) is a chemical compound with molecular formula C8H19O3PS2 and molecular weight 258.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxy-methyl-[2-[(S)-propylsulfinyl]ethoxy]-sulfanylidene-λ5-phosphane
Also Known As: Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester, O-Ethyl O-[2-(propane-1-sulfinyl)ethyl] methylphosphonothioate, O-Ethyl O-{2-[(S)-propane-1-sulfinyl]ethyl} methylphosphonothioate, Ethoxy-methyl-[2-[(S)-propylsulfinyl]ethoxy]-sulfanylidene-phosphorane, Phosphonothioic acid,methyl-,o-ethyl s-[2-(propylsulfinyl)ethyl]ester(9ci)
| Molecular Formula | C8H19O3PS2 |
|---|---|
| Molecular Weight | 258.05 g/mol |
| LogP | 2.1375 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 258.05133 |
| Heavy Atoms | 14 |
| Complexity | 220.63193 |
Chemical Identifiers
| CAS Number | 53151-69-2 |
|---|---|
| SMILES | CCC[S@](=O)CCOP(=S)(C)OCC |
Product Overview
Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester (CAS 53151-69-2), with molecular formula C8H19O3PS2 and molecular weight 258.05 g/mol. IUPAC: ethoxy-methyl-[2-[(S)-propylsulfinyl]ethoxy]-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester
Property Insights of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester
The XLogP value of 2.1375 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester. With a topological polar surface area (TPSA) of 35.53 Ų, Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) 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 Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester?
The CAS number of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester is 53151-69-2.
What is the molecular formula of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester?
The molecular formula of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester is C8H19O3PS2.
What is the molecular weight of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester?
The molecular weight of Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester is 258.05 g/mol.
Where can I buy Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester?
You can request a quote for Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, methyl-, O-ethyl S-(2-(propylsulfinyl)ethyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.