tert-Butyl 7,7-dimethylperoxyoctanoate
TL;DR: tert-Butyl 7,7-dimethylperoxyoctanoate (CAS 26748-41-4) is a chemical compound with molecular formula C14H28O3 and molecular weight 244.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 7,7-dimethyloctaneperoxoate
Also Known As: Esperox 33M, tert-Butyl peroxyneodecanoate, Lupersol 10M-75, Lupersol-10M-75, PERBUTYL ND
| Molecular Formula | C14H28O3 |
|---|---|
| Molecular Weight | 244.20 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 244.20384 |
| Heavy Atoms | 17 |
| Complexity | 221.0 |
Chemical Identifiers
| CAS Number | 26748-41-4 |
|---|---|
| SMILES | CC(C)(C)CCCCCC(=O)OOC(C)(C)C |
| InChIKey | NMOALOSNPWTWRH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
tert-Butyl 7,7-dimethylperoxyoctanoate (CAS 26748-41-4), with molecular formula C14H28O3 and molecular weight 244.20 g/mol. IUPAC: tert-butyl 7,7-dimethyloctaneperoxoate.
Chemical Property Profile of tert-Butyl 7,7-dimethylperoxyoctanoate
Property Insights of tert-Butyl 7,7-dimethylperoxyoctanoate
The XLogP value of 4.8 indicates that tert-Butyl 7,7-dimethylperoxyoctanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, tert-Butyl 7,7-dimethylperoxyoctanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl 7,7-dimethylperoxyoctanoate has 0 hydrogen bond donor(s) and 3 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 tert-Butyl 7,7-dimethylperoxyoctanoate?
The CAS number of tert-Butyl 7,7-dimethylperoxyoctanoate is 26748-41-4.
What is the molecular formula of tert-Butyl 7,7-dimethylperoxyoctanoate?
The molecular formula of tert-Butyl 7,7-dimethylperoxyoctanoate is C14H28O3.
What is the molecular weight of tert-Butyl 7,7-dimethylperoxyoctanoate?
The molecular weight of tert-Butyl 7,7-dimethylperoxyoctanoate is 244.20 g/mol.
Where can I buy tert-Butyl 7,7-dimethylperoxyoctanoate?
You can request a quote for tert-Butyl 7,7-dimethylperoxyoctanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl 7,7-dimethylperoxyoctanoate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl 7,7-dimethylperoxyoctanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.