Demeton-O-methyl sulfone
TL;DR: Demeton-O-methyl sulfone (CAS 25476-48-6) 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.
2-ethylsulfonylethoxy-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: Demeton-O-methyl sulfone, Methylsystox sulfone, Demeton O-methyl sulfone, Disulfoton oxygen analog sulfone, Dimethyl 2-ethsulfonylethylthionophosphate
| Molecular Formula | C6H15O5PS2 |
|---|---|
| Molecular Weight | 262.01 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 102.0 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 | 25476-48-6 |
|---|---|
| SMILES | CCS(=O)(=O)CCOP(=S)(OC)OC |
| InChIKey | UQNYAMFNNOTGCQ-UHFFFAOYSA-N |
Product Overview
Demeton-O-methyl sulfone (CAS 25476-48-6), with molecular formula C6H15O5PS2 and molecular weight 262.01 g/mol. IUPAC: 2-ethylsulfonylethoxy-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Demeton-O-methyl sulfone
Property Insights of Demeton-O-methyl sulfone
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Demeton-O-methyl sulfone. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Demeton-O-methyl sulfone. Following Lipinski's Rule of Five, Demeton-O-methyl sulfone 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-O-methyl sulfone?
The CAS number of Demeton-O-methyl sulfone is 25476-48-6.
What is the molecular formula of Demeton-O-methyl sulfone?
The molecular formula of Demeton-O-methyl sulfone is C6H15O5PS2.
What is the molecular weight of Demeton-O-methyl sulfone?
The molecular weight of Demeton-O-methyl sulfone is 262.01 g/mol.
Where can I buy Demeton-O-methyl sulfone?
You can request a quote for Demeton-O-methyl sulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Demeton-O-methyl sulfone?
Yes, KEHONG BIO provides custom synthesis services for Demeton-O-methyl sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.