1,1,2-Tritolylethane
TL;DR: 1,1,2-Tritolylethane (CAS 27497-47-8) is a chemical compound with molecular formula C23H24 and molecular weight 300.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1,2-bis(4-methylphenyl)ethyl]-4-methylbenzene
Also Known As: 1,1,2-Tritolylethane, 1-[1,2-bis(4-methylphenyl)ethyl]-4-methylbenzene, 1,1',1''-(Ethane-1,1,2-triyl)tris(4-methylbenzene)
| Molecular Formula | C23H24 |
|---|---|
| Molecular Weight | 300.19 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.1878 |
| Heavy Atoms | 23 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 27497-47-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)CC(C2=CC=C(C=C2)C)C3=CC=C(C=C3)C |
| InChIKey | UELJFQQBQVFDMT-UHFFFAOYSA-N |
Product Overview
1,1,2-Tritolylethane (CAS 27497-47-8), with molecular formula C23H24 and molecular weight 300.19 g/mol. IUPAC: 1-[1,2-bis(4-methylphenyl)ethyl]-4-methylbenzene.
Chemical Property Profile of 1,1,2-Tritolylethane
Property Insights of 1,1,2-Tritolylethane
The XLogP value of 6.7 indicates that 1,1,2-Tritolylethane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,1,2-Tritolylethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,2-Tritolylethane 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 1,1,2-Tritolylethane?
The CAS number of 1,1,2-Tritolylethane is 27497-47-8.
What is the molecular formula of 1,1,2-Tritolylethane?
The molecular formula of 1,1,2-Tritolylethane is C23H24.
What is the molecular weight of 1,1,2-Tritolylethane?
The molecular weight of 1,1,2-Tritolylethane is 300.19 g/mol.
Where can I buy 1,1,2-Tritolylethane?
You can request a quote for 1,1,2-Tritolylethane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,2-Tritolylethane?
Yes, KEHONG BIO provides custom synthesis services for 1,1,2-Tritolylethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.