RefChem:548838
TL;DR: RefChem:548838 (CAS 67859-61-4) is a chemical compound with molecular formula C48H88O4S2Sn and molecular weight 912.51 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[dibutyl-[2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxyethylsulfanyl]stannyl]sulfanylethyl (9Z,12Z)-octadeca-9,12-dienoate
Also Known As: EINECS 267-409-6, Dibutyltinbis(2-linoleoyloxyethylmercaptide), 9,12-Octadecadienoic acid (9Z,12Z)-, (dibutylstannylene)bis(thio-2,1-ethanediyl) ester, 9,12-Octadecadienoic acid (9Z,12Z)-, 1,1'-((dibutylstannylene)bis(thio-2,1-ethanediyl)) ester, (Dibutylstannylene)bis(thioethane-1,2-diyl) bis((9Z,12Z)-octadeca-9,12-dienoate)
| Molecular Formula | C48H88O4S2Sn |
|---|---|
| Molecular Weight | 912.51 g/mol |
| LogP | 16.2086 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 42 |
| Exact Mass | 912.5146 |
| Heavy Atoms | 55 |
| Complexity | 887.58154 |
Chemical Identifiers
| CAS Number | 67859-61-4 |
|---|---|
| SMILES | CCCCC/C=C\C/C=C\CCCCCCCC(=O)OCCS[Sn](SCCOC(=O)CCCCCCC/C=C\C/C=C\CCCCC)(CCCC)CCCC |
Product Overview
RefChem:548838 (CAS 67859-61-4), with molecular formula C48H88O4S2Sn and molecular weight 912.51 g/mol. IUPAC: 2-[dibutyl-[2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxyethylsulfanyl]stannyl]sulfanylethyl (9Z,12Z)-octadeca-9,12-dienoate.
Chemical Property Profile of RefChem:548838
Property Insights of RefChem:548838
The XLogP value of 16.2086 indicates that RefChem:548838 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, RefChem:548838 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:548838 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:548838?
The CAS number of RefChem:548838 is 67859-61-4.
What is the molecular formula of RefChem:548838?
The molecular formula of RefChem:548838 is C48H88O4S2Sn.
What is the molecular weight of RefChem:548838?
The molecular weight of RefChem:548838 is 912.51 g/mol.
Where can I buy RefChem:548838?
You can request a quote for RefChem:548838 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:548838?
Yes, KEHONG BIO provides custom synthesis services for RefChem:548838 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.