Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester
TL;DR: Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester (CAS 50824-96-9) is a chemical compound with molecular formula C10H23O2PS2 and molecular weight 270.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethyl(2-ethylsulfanylethylsulfanyl)phosphoryl]oxybutane
Also Known As: O-sec-Butyl S-2-(ethylthio)ethyl ethylphosphonothioate, O-2-Butyl S-2-(ethylthio)ethyl ethylphosphonothioate, Phosphonothioic acid, ethyl-, O-sec-butyl S-2-(ethylthio)ethyl ester, Ethylphosphonothioic acid S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester, 2-[ethyl(2-ethylsulfanylethylsulfanyl)phosphoryl]oxybutane
| Molecular Formula | C10H23O2PS2 |
|---|---|
| Molecular Weight | 270.09 g/mol |
| LogP | 4.5008 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 270.0877 |
| Heavy Atoms | 15 |
| Complexity | 199.8614 |
Chemical Identifiers
| CAS Number | 50824-96-9 |
|---|---|
| SMILES | CCC(C)OP(=O)(CC)SCCSCC |
Product Overview
Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester (CAS 50824-96-9), with molecular formula C10H23O2PS2 and molecular weight 270.09 g/mol. IUPAC: 2-[ethyl(2-ethylsulfanylethylsulfanyl)phosphoryl]oxybutane.
Chemical Property Profile of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester
Property Insights of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester
The XLogP value of 4.5008 indicates that Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) 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, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester?
The CAS number of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester is 50824-96-9.
What is the molecular formula of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester?
The molecular formula of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester is C10H23O2PS2.
What is the molecular weight of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester?
The molecular weight of Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester is 270.09 g/mol.
Where can I buy Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester?
You can request a quote for Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) 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, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, ethyl-, S-(2-(ethylthio)ethyl) O-(1-methylpropyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.