Acetoxon
TL;DR: Acetoxon (CAS 2425-25-4) is a chemical compound with molecular formula C8H17O5PS and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-diethoxyphosphorylsulfanylacetate
Also Known As: Acetophos, ACETOXON, Acetaphos, Acetofos, ACETOXON [HSDB]
| Molecular Formula | C8H17O5PS |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 87.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 256.05344 |
| Heavy Atoms | 15 |
| Complexity | 223.0 |
| Boiling Point | BP: 73 °C at 0.005 mm Hg |
Chemical Identifiers
| CAS Number | 2425-25-4 |
|---|---|
| SMILES | CCOC(=O)CSP(=O)(OCC)OCC |
| InChIKey | ZRCQYAQOWIQUBA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetoxon (CAS 2425-25-4), with molecular formula C8H17O5PS and molecular weight 256.05 g/mol. IUPAC: ethyl 2-diethoxyphosphorylsulfanylacetate.
Chemical Property Profile of Acetoxon
Property Insights of Acetoxon
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acetoxon. The TPSA of 87.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetoxon. Following Lipinski's Rule of Five, Acetoxon has 0 hydrogen bond donor(s) and 6 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 Acetoxon?
The CAS number of Acetoxon is 2425-25-4.
What is the molecular formula of Acetoxon?
The molecular formula of Acetoxon is C8H17O5PS.
What is the molecular weight of Acetoxon?
The molecular weight of Acetoxon is 256.05 g/mol.
Where can I buy Acetoxon?
You can request a quote for Acetoxon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetoxon?
Yes, KEHONG BIO provides custom synthesis services for Acetoxon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.