Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure] structure

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

CAS: 55794-20-2
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.

Agrochemicals (4 patents) Analytical Reagents (7 patents) Biotechnology (9 patents) Catalysts (3 patents) Coatings & Adhesives (75 patents) +17 more

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.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Ethyl-3,3-DI-(tert-butylperoxy)butyrate, [technically pure]

XLogP
2.5
TPSA (Topological Polar Surface Area)
63.2
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
10
Heavy Atoms
20
Complexity
282.0
Exact Mass
292.1886
Monoisotopic Mass
292.1886
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

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

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

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.

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