Demeton-o sulfone
TL;DR: Demeton-o sulfone (CAS 4891-54-7) is a chemical compound with molecular formula C8H19O5PS2 and molecular weight 290.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-(2-ethylsulfonylethoxy)-sulfanylidene-λ5-phosphane
Also Known As: Demeton-o sulfone, Systox sulfone, Demeton-sulfone, DEMETON-O-SULFONE, THIONODEMETON SULFONE
| Molecular Formula | C8H19O5PS2 |
|---|---|
| Molecular Weight | 290.04 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 290.04117 |
| Heavy Atoms | 16 |
| Complexity | 312.0 |
Chemical Identifiers
| CAS Number | 4891-54-7 |
|---|---|
| SMILES | CCOP(=S)(OCC)OCCS(=O)(=O)CC |
| InChIKey | GZJFADYLHPWSII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Demeton-o sulfone (CAS 4891-54-7), with molecular formula C8H19O5PS2 and molecular weight 290.04 g/mol. IUPAC: diethoxy-(2-ethylsulfonylethoxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Demeton-o sulfone
Property Insights of Demeton-o sulfone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Demeton-o sulfone. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Demeton-o sulfone. Following Lipinski's Rule of Five, Demeton-o 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 sulfone?
The CAS number of Demeton-o sulfone is 4891-54-7.
What is the molecular formula of Demeton-o sulfone?
The molecular formula of Demeton-o sulfone is C8H19O5PS2.
What is the molecular weight of Demeton-o sulfone?
The molecular weight of Demeton-o sulfone is 290.04 g/mol.
Where can I buy Demeton-o sulfone?
You can request a quote for Demeton-o 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 sulfone?
Yes, KEHONG BIO provides custom synthesis services for Demeton-o sulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.