tris trioleate
TL;DR: tris trioleate (CAS 59118-79-5) is a chemical compound with molecular formula C61H114O6S3Sn and molecular weight 1158.68 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl-bis[2-[(Z)-octadec-9-enoyl]oxyethylsulfanyl]stannyl]sulfanylethyl (Z)-octadec-9-enoate
Also Known As: tris trioleate, EINECS 261-610-2, Methyltin tris(2-mercaptoethyl oleate), (Methylstannylidyne)tris(thioethylene) trioleate, 9-Octadecenoic acid (9Z)-, (methylstannylidyne)tris(thio-2,1-ethanediyl) ester
| Molecular Formula | C61H114O6S3Sn |
|---|---|
| Molecular Weight | 1158.68 g/mol |
| LogP | 20.4968 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 57 |
| Exact Mass | 1158.6799 |
| Heavy Atoms | 71 |
| Complexity | 1099.4745 |
Chemical Identifiers
| CAS Number | 59118-79-5 |
|---|---|
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCCS[Sn](SCCOC(=O)CCCCCCC/C=C\CCCCCCCC)(SCCOC(=O)CCCCCCC/C=C\CCCCCCCC)C |
Product Overview
tris trioleate (CAS 59118-79-5), with molecular formula C61H114O6S3Sn and molecular weight 1158.68 g/mol. IUPAC: 2-[methyl-bis[2-[(Z)-octadec-9-enoyl]oxyethylsulfanyl]stannyl]sulfanylethyl (Z)-octadec-9-enoate.
Chemical Property Profile of tris trioleate
Property Insights of tris trioleate
The XLogP value of 20.4968 indicates that tris trioleate 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 trioleate. Following Lipinski's Rule of Five, tris trioleate 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 trioleate?
The CAS number of tris trioleate is 59118-79-5.
What is the molecular formula of tris trioleate?
The molecular formula of tris trioleate is C61H114O6S3Sn.
What is the molecular weight of tris trioleate?
The molecular weight of tris trioleate is 1158.68 g/mol.
Where can I buy tris trioleate?
You can request a quote for tris trioleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tris trioleate?
Yes, KEHONG BIO provides custom synthesis services for tris trioleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.