O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate
TL;DR: O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate (CAS 98543-25-0) is a chemical compound with molecular formula C8H20NO2PS and molecular weight 225.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[ethoxy(ethyl)phosphoryl]sulfanyl-N,N-dimethylethanamine
Also Known As: O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate, S-[2-(Dimethylamino)ethyl] o-ethyl ethylphosphonothioate, o-Ethyl S-2-(dimethylamino)ethyl ethylphosphonothiolate, 2-[ethoxy(ethyl)phosphoryl]sulfanyl-N,N-dimethylethanamine, S-[2-(Dimethylamino)ethyl] o-ethyl ethylphosphonothioate #
| Molecular Formula | C8H20NO2PS |
|---|---|
| Molecular Weight | 225.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 54.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 225.09523 |
| Heavy Atoms | 13 |
| Complexity | 176.0 |
Chemical Identifiers
| CAS Number | 98543-25-0 |
|---|---|
| SMILES | CCOP(=O)(CC)SCCN(C)C |
| InChIKey | LLMAYCPOBKHQIP-UHFFFAOYSA-N |
Product Overview
O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate (CAS 98543-25-0), with molecular formula C8H20NO2PS and molecular weight 225.10 g/mol. IUPAC: 2-[ethoxy(ethyl)phosphoryl]sulfanyl-N,N-dimethylethanamine.
Chemical Property Profile of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate
Property Insights of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate. With a topological polar surface area (TPSA) of 54.8 Ų, O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate 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 O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate?
The CAS number of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate is 98543-25-0.
What is the molecular formula of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate?
The molecular formula of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate is C8H20NO2PS.
What is the molecular weight of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate?
The molecular weight of O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate is 225.10 g/mol.
Where can I buy O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate?
You can request a quote for O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate 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-2-dimethylaminoethyl ethylphosphonothiolate?
Yes, KEHONG BIO provides custom synthesis services for O-Ethyl S-2-dimethylaminoethyl ethylphosphonothiolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.