Demeton-S-methylsulphon
TL;DR: Demeton-S-methylsulphon (CAS 17040-19-6) is a chemical compound with molecular formula C6H15O5PS2 and molecular weight 262.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dimethoxyphosphorylsulfanyl-2-ethylsulfonylethane
Also Known As: Demeton-S-methyl sulfone, Demeton-S-methylsulphon, Demeton-S-methylsulfone, Dioxydemeton-S-methyl, Isometasystox sulfone
| Molecular Formula | C6H15O5PS2 |
|---|---|
| Molecular Weight | 262.01 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 262.00986 |
| Heavy Atoms | 14 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 17040-19-6 |
|---|---|
| SMILES | CCS(=O)(=O)CCSP(=O)(OC)OC |
| InChIKey | PZIRJMYRYORVIT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Demeton-S-methylsulphon (CAS 17040-19-6), with molecular formula C6H15O5PS2 and molecular weight 262.01 g/mol. IUPAC: 1-dimethoxyphosphorylsulfanyl-2-ethylsulfonylethane.
Chemical Property Profile of Demeton-S-methylsulphon
Property Insights of Demeton-S-methylsulphon
The XLogP value of -0.3 indicates that Demeton-S-methylsulphon is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Demeton-S-methylsulphon. Following Lipinski's Rule of Five, Demeton-S-methylsulphon 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 Demeton-S-methylsulphon?
The CAS number of Demeton-S-methylsulphon is 17040-19-6.
What is the molecular formula of Demeton-S-methylsulphon?
The molecular formula of Demeton-S-methylsulphon is C6H15O5PS2.
What is the molecular weight of Demeton-S-methylsulphon?
The molecular weight of Demeton-S-methylsulphon is 262.01 g/mol.
Where can I buy Demeton-S-methylsulphon?
You can request a quote for Demeton-S-methylsulphon directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Demeton-S-methylsulphon?
Yes, KEHONG BIO provides custom synthesis services for Demeton-S-methylsulphon and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.