13,16-Dithiaoctacosane
TL;DR: 13,16-Dithiaoctacosane (CAS 10050-04-1) is a chemical compound with molecular formula C26H54S2 and molecular weight 430.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-dodecylsulfanylethylsulfanyl)dodecane
Also Known As: 13,16-DITHIAOCTACOSANE, 1-(2-dodecylsulfanylethylsulfanyl)dodecane, 1,2-BIS(DODECYLTHIO)ETHANE, 1,2-DILAURYL DITHIOETHYLENE, Dodecane, 1,1'-(1,2-ethanediylbis(thio))bis-
| Molecular Formula | C26H54S2 |
|---|---|
| Molecular Weight | 430.37 g/mol |
| LogP | 12.7 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 25 |
| Exact Mass | 430.3667 |
| Heavy Atoms | 28 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 10050-04-1 |
|---|---|
| SMILES | CCCCCCCCCCCCSCCSCCCCCCCCCCCC |
| InChIKey | WXXCXXVZIQCGNZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
13,16-Dithiaoctacosane (CAS 10050-04-1), with molecular formula C26H54S2 and molecular weight 430.37 g/mol. IUPAC: 1-(2-dodecylsulfanylethylsulfanyl)dodecane.
Chemical Property Profile of 13,16-Dithiaoctacosane
Property Insights of 13,16-Dithiaoctacosane
The XLogP value of 12.7 indicates that 13,16-Dithiaoctacosane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, 13,16-Dithiaoctacosane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 13,16-Dithiaoctacosane has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 13,16-Dithiaoctacosane?
The CAS number of 13,16-Dithiaoctacosane is 10050-04-1.
What is the molecular formula of 13,16-Dithiaoctacosane?
The molecular formula of 13,16-Dithiaoctacosane is C26H54S2.
What is the molecular weight of 13,16-Dithiaoctacosane?
The molecular weight of 13,16-Dithiaoctacosane is 430.37 g/mol.
Where can I buy 13,16-Dithiaoctacosane?
You can request a quote for 13,16-Dithiaoctacosane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 13,16-Dithiaoctacosane?
Yes, KEHONG BIO provides custom synthesis services for 13,16-Dithiaoctacosane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.