乙基硫代膦酸O,S-二甲酯
TL;DR: 乙基硫代膦酸O,S-二甲酯 (CAS 108813-13-4) is a chemical compound with molecular formula C4H11O2PS and molecular weight 154.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙基硫代膦酸O,S-二甲酯
1-[methoxy(methylsulfanyl)phosphoryl]ethane
Also Known As: Isononyl mercaptoacetate, O,S-Dimethyl ethanethiophosphonate, o,S-Dimethyl ethylphosphonothioate, Ethylphosphonothioic acid O,S-dimethyl ester, Phosphonothioic acid, ethyl-, O,S-dimethyl ester
| Molecular Formula | C4H11O2PS |
|---|---|
| Molecular Weight | 154.02 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.02174 |
| Heavy Atoms | 8 |
| Complexity | 104.0 |
Chemical Identifiers
| CAS Number | 108813-13-4 |
|---|---|
| SMILES | CCP(=O)(OC)SC |
| InChIKey | ZEOAMTWWLDATMW-UHFFFAOYSA-N |
Product Overview
乙基硫代膦酸O,S-二甲酯 (CAS 108813-13-4), with molecular formula C4H11O2PS and molecular weight 154.02 g/mol. IUPAC: 1-[methoxy(methylsulfanyl)phosphoryl]ethane.
Chemical Property Profile of 乙基硫代膦酸O,S-二甲酯
Property Insights of 乙基硫代膦酸O,S-二甲酯
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙基硫代膦酸O,S-二甲酯. With a topological polar surface area (TPSA) of 51.6 Ų, 乙基硫代膦酸O,S-二甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙基硫代膦酸O,S-二甲酯 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 乙基硫代膦酸O,S-二甲酯?
The CAS number of 乙基硫代膦酸O,S-二甲酯 is 108813-13-4.
What is the molecular formula of 乙基硫代膦酸O,S-二甲酯?
The molecular formula of 乙基硫代膦酸O,S-二甲酯 is C4H11O2PS.
What is the molecular weight of 乙基硫代膦酸O,S-二甲酯?
The molecular weight of 乙基硫代膦酸O,S-二甲酯 is 154.02 g/mol.
Where can I buy 乙基硫代膦酸O,S-二甲酯?
You can request a quote for 乙基硫代膦酸O,S-二甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙基硫代膦酸O,S-二甲酯?
Yes, KEHONG BIO provides custom synthesis services for 乙基硫代膦酸O,S-二甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.