Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)
TL;DR: Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) (CAS 66-32-0) is a chemical compound with molecular formula C38H74O6S3Sn and molecular weight 842.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)
Also Known As: 2-(2-ethylhexoxy)-2-oxo-ethanethiolate; octyltin, Octyltin Tris(2-ethylhexyl Mercaptoacetate), 2-(2-ethylhexoxy)-2-oxoethanethiolate; octyltin(3+)
| Molecular Formula | C38H74O6S3Sn |
|---|---|
| Molecular Weight | 842.37 g/mol |
| LogP | 9.8124 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 27 |
| Exact Mass | 842.36694 |
| Heavy Atoms | 48 |
| Complexity | 590.2637 |
Chemical Identifiers
| CAS Number | 66-32-0 |
|---|---|
| SMILES | CCCCCCCC[Sn+3].CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-].CCCCC(CC)COC(=O)C[S-] |
Product Overview
Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) (CAS 66-32-0), with molecular formula C38H74O6S3Sn and molecular weight 842.37 g/mol. IUPAC: tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+).
Chemical Property Profile of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)
Property Insights of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)
The XLogP value of 9.8124 indicates that Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+). Following Lipinski's Rule of Five, Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)?
The CAS number of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) is 66-32-0.
What is the molecular formula of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)?
The molecular formula of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) is C38H74O6S3Sn.
What is the molecular weight of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)?
The molecular weight of Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) is 842.37 g/mol.
Where can I buy Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)?
You can request a quote for Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+)?
Yes, KEHONG BIO provides custom synthesis services for Tris(2-(2-ethylhexoxy)-2-oxoethanethiolate);octyltin(3+) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.