4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane
TL;DR: 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane (CAS 85668-73-1) is a chemical compound with molecular formula C32H50 and molecular weight 434.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-4-[5-(4-tert-butylphenyl)-4,5-diethyloctan-4-yl]benzene
Also Known As: 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane, 4,5-Diethyl-4,5-bis-(4-tert-butylphrenyl)octane, 4,5-Diethyl-4,5-bis-(4-tert-butylphenyl)-octane, 1,1'-(4,5-diethyloctane-4,5-diyl)bis(4-tert-butylbenzene), 1-tert-butyl-4-[5-(4-tert-butylphenyl)-4,5-diethyloctan-4-yl]benzene
| Molecular Formula | C32H50 |
|---|---|
| Molecular Weight | 434.39 g/mol |
| LogP | 12.5 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 11 |
| Exact Mass | 434.39127 |
| Heavy Atoms | 32 |
| Complexity | 479.0 |
Chemical Identifiers
| CAS Number | 85668-73-1 |
|---|---|
| SMILES | CCCC(CC)(C1=CC=C(C=C1)C(C)(C)C)C(CC)(CCC)C2=CC=C(C=C2)C(C)(C)C |
| InChIKey | DTOQQIZHGNEYCR-UHFFFAOYSA-N |
Product Overview
4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane (CAS 85668-73-1), with molecular formula C32H50 and molecular weight 434.39 g/mol. IUPAC: 1-tert-butyl-4-[5-(4-tert-butylphenyl)-4,5-diethyloctan-4-yl]benzene.
Chemical Property Profile of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane
Property Insights of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane
The XLogP value of 12.5 indicates that 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane?
The CAS number of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane is 85668-73-1.
What is the molecular formula of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane?
The molecular formula of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane is C32H50.
What is the molecular weight of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane?
The molecular weight of 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane is 434.39 g/mol.
Where can I buy 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane?
You can request a quote for 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Diethyl-4,5-bis(4-tert-butylphenyl)octane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.