3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane
TL;DR: 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane (CAS 85668-74-2) is a chemical compound with molecular formula C30H46 and molecular weight 406.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-tert-butyl-4-[2-(4-tert-butylphenyl)-1,1-diethyl-3-methylpentyl]benzene
Also Known As: 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane, 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)-hexane, 1-tert-butyl-4-[3-(4-tert-butylphenyl)-3-ethyl-5-methylheptan-4-yl]benzene, 3-ETHYL-5-METHYL-3,4-BIS(4-TERT-BUTYLPHENYL)HEPTANE, 1,1'-(3-Ethyl-5-methylheptane-3,4-diyl)bis(4-tert-butylbenzene)
| Molecular Formula | C30H46 |
|---|---|
| Molecular Weight | 406.36 g/mol |
| LogP | 11.1 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 9 |
| Exact Mass | 406.35995 |
| Heavy Atoms | 30 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 85668-74-2 |
|---|---|
| SMILES | CCC(C)C(C1=CC=C(C=C1)C(C)(C)C)C(CC)(CC)C2=CC=C(C=C2)C(C)(C)C |
| InChIKey | WNLBDFYTLIBLQU-UHFFFAOYSA-N |
Product Overview
3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane (CAS 85668-74-2), with molecular formula C30H46 and molecular weight 406.36 g/mol. IUPAC: 1-tert-butyl-4-[2-(4-tert-butylphenyl)-1,1-diethyl-3-methylpentyl]benzene.
Chemical Property Profile of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane
Property Insights of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane
The XLogP value of 11.1 indicates that 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane 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 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane?
The CAS number of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane is 85668-74-2.
What is the molecular formula of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane?
The molecular formula of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane is C30H46.
What is the molecular weight of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane?
The molecular weight of 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane is 406.36 g/mol.
Where can I buy 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane?
You can request a quote for 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Diethyl-3,4-bis(4-tert-butylphenyl)hexane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.