Phosphinothioic acid, diethyl-, S-ethyl ester
TL;DR: Phosphinothioic acid, diethyl-, S-ethyl ester (CAS 4885-47-6) is a chemical compound with molecular formula C6H15OPS and molecular weight 166.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[ethyl(ethylsulfanyl)phosphoryl]ethane
Also Known As: Phosphinothioic acid, diethyl-, S-ethyl ester, S-ETHYL DIETHYLPHOSPHINOTHIOATE, 1-[ethyl(ethylsulfanyl)phosphoryl]ethane, Phosphinothioic acid,diethyl-,S-ethyl ester
| Molecular Formula | C6H15OPS |
|---|---|
| Molecular Weight | 166.06 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 166.05812 |
| Heavy Atoms | 9 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 4885-47-6 |
|---|---|
| SMILES | CCP(=O)(CC)SCC |
| InChIKey | YPGYWXZHIBPSQN-UHFFFAOYSA-N |
Product Overview
Phosphinothioic acid, diethyl-, S-ethyl ester (CAS 4885-47-6), with molecular formula C6H15OPS and molecular weight 166.06 g/mol. IUPAC: 1-[ethyl(ethylsulfanyl)phosphoryl]ethane.
Chemical Property Profile of Phosphinothioic acid, diethyl-, S-ethyl ester
Property Insights of Phosphinothioic acid, diethyl-, S-ethyl ester
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphinothioic acid, diethyl-, S-ethyl ester. With a topological polar surface area (TPSA) of 42.4 Ų, Phosphinothioic acid, diethyl-, S-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphinothioic acid, diethyl-, S-ethyl ester has 0 hydrogen bond donor(s) and 2 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 Phosphinothioic acid, diethyl-, S-ethyl ester?
The CAS number of Phosphinothioic acid, diethyl-, S-ethyl ester is 4885-47-6.
What is the molecular formula of Phosphinothioic acid, diethyl-, S-ethyl ester?
The molecular formula of Phosphinothioic acid, diethyl-, S-ethyl ester is C6H15OPS.
What is the molecular weight of Phosphinothioic acid, diethyl-, S-ethyl ester?
The molecular weight of Phosphinothioic acid, diethyl-, S-ethyl ester is 166.06 g/mol.
Where can I buy Phosphinothioic acid, diethyl-, S-ethyl ester?
You can request a quote for Phosphinothioic acid, diethyl-, S-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphinothioic acid, diethyl-, S-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphinothioic acid, diethyl-, S-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.