Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]
TL;DR: Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] (CAS 55794-20-2) is a chemical compound with molecular formula C14H28O6 and molecular weight 292.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3-bis(tert-butylperoxy)butanoate
Also Known As: ethyl 3,3-bis(tert-butylperoxy)butanoate, LUPERCO 233XL, LUPERSOL 233, LUPERSOL 233M75, LUPERSOL 233M090
| Molecular Formula | C14H28O6 |
|---|---|
| Molecular Weight | 292.19 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 63.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 292.1886 |
| Heavy Atoms | 20 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 55794-20-2 |
|---|---|
| SMILES | CCOC(=O)CC(C)(OOC(C)(C)C)OOC(C)(C)C |
| InChIKey | HARQWLDROVMFJE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] (CAS 55794-20-2), with molecular formula C14H28O6 and molecular weight 292.19 g/mol. IUPAC: ethyl 3,3-bis(tert-butylperoxy)butanoate.
Chemical Property Profile of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]
Property Insights of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]. The TPSA of 63.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]. Following Lipinski's Rule of Five, Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]?
The CAS number of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] is 55794-20-2.
What is the molecular formula of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]?
The molecular formula of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] is C14H28O6.
What is the molecular weight of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]?
The molecular weight of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] is 292.19 g/mol.
Where can I buy Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]?
You can request a quote for Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]?
Yes, KEHONG BIO provides custom synthesis services for Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.