Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester
TL;DR: Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester (CAS 59118-80-8) is a chemical compound with molecular formula C34H66O6S3Sn and molecular weight 786.3044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[butyl-bis(2-octanoyloxyethylsulfanyl)stannyl]sulfanylethyl octanoate
Also Known As: Butyltintris(2-octanoyloxyethylmercaptide), Butyltintris[2-(octanoyloxy)ethylmercaptide], Butyltintris(2-(octanoyloxy)ethylmercaptide), (Butylstannylidyne)tris(thioethylene) trioctanoate, Octanoic acid, (butylstannylidyne)tris(thio-2,1-ethanediyl) ester
Technical Specifications
| Molecular Formula | C34H66O6S3Sn |
| Molecular Weight | 786.3044 g/mol |
| XLogP | 10.64 |
| Topological Polar Surface Area (TPSA) | 155.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 36 |
| Exact Mass | 786.3044 Da |
| Heavy Atoms | 44 |
| Complexity | 614.0 |
| SMILES | CCCCCCCC(=O)OCCS[Sn](CCCC)(SCCOC(=O)CCCCCCC)SCCOC(=O)CCCCCCC |
| InChIKey | FXMZXUNYBBSBCI-UHFFFAOYSA-K |
Chemical Property Profile of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester
Property Insights of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester
The XLogP value of 10.64 indicates that Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 155.0 Ų indicates high polarity, suggesting Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester?
The CAS number of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester is 59118-80-8.
What is the molecular formula of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester?
The molecular formula of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester is C34H66O6S3Sn.
What is the molecular weight of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester?
The molecular weight of Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester is 786.3044 g/mol.
Where can I buy Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester?
You can request a quote for Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester?
Yes, CoreyChem provides custom synthesis services for Octanoic acid, 1,1',1''-((butylstannylidyne)tris(thio-2,1-ethanediyl)) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.