2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane
TL;DR: 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane (CAS 23661-84-9) is a chemical compound with molecular formula C12H26O4 and molecular weight 234.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butylperoxy-5-hydroperoxy-2,5-dimethylhexane
Also Known As: 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane, 2-tert-butylperoxy-5-hydroperoxy-2,5-dimethylhexane, 5-t-butylperoxy-2-hydroperoxy-2,5-dimethylhexane, 5-(TERT-BUTYLPEROXY)-2,5-DIMETHYLHEXANE-2-PEROXOL, 2-(tert-butylperoxy)-5-hydroperoxy-2,5-dimethylhexane
| Molecular Formula | C12H26O4 |
|---|---|
| Molecular Weight | 234.18 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 47.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 234.1831 |
| Heavy Atoms | 16 |
| Complexity | 204.0 |
Chemical Identifiers
| CAS Number | 23661-84-9 |
|---|---|
| SMILES | CC(C)(C)OOC(C)(C)CCC(C)(C)OO |
| InChIKey | LMYXBQKXPSZHAH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane (CAS 23661-84-9), with molecular formula C12H26O4 and molecular weight 234.18 g/mol. IUPAC: 2-tert-butylperoxy-5-hydroperoxy-2,5-dimethylhexane.
Chemical Property Profile of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane
Property Insights of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane. With a topological polar surface area (TPSA) of 47.9 Ų, 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane has 1 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 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane?
The CAS number of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane is 23661-84-9.
What is the molecular formula of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane?
The molecular formula of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane is C12H26O4.
What is the molecular weight of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane?
The molecular weight of 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane is 234.18 g/mol.
Where can I buy 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane?
You can request a quote for 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-2-hydroperoxide-5-tert-butylperoxyhexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.