1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane
TL;DR: 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane (CAS 6731-36-8) is a chemical compound with molecular formula C17H34O4 and molecular weight 302.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1-bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane
Also Known As: Perhexa 3M, Trigonox 29, Luperox 231, Luperco 231G, Lupersol 231
| Molecular Formula | C17H34O4 |
|---|---|
| Molecular Weight | 302.25 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 36.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 302.2457 |
| Heavy Atoms | 21 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 6731-36-8 |
|---|---|
| SMILES | CC1CC(CC(C1)(OOC(C)(C)C)OOC(C)(C)C)(C)C |
| InChIKey | NALFRYPTRXKZPN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane (CAS 6731-36-8), with molecular formula C17H34O4 and molecular weight 302.25 g/mol. IUPAC: 1,1-bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane.
Chemical Property Profile of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane
Property Insights of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane
The XLogP value of 5.0 indicates that 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.9 Ų, 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane has 0 hydrogen bond donor(s) and 4 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 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane?
The CAS number of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane is 6731-36-8.
What is the molecular formula of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane?
The molecular formula of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane is C17H34O4.
What is the molecular weight of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane?
The molecular weight of 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane is 302.25 g/mol.
Where can I buy 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane?
You can request a quote for 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Bis(tert-butylperoxy)-3,3,5-trimethylcyclohexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.