1,1-Bis(3,4-dimethylphenyl)ethane
TL;DR: 1,1-Bis(3,4-dimethylphenyl)ethane (CAS 1742-14-9) is a chemical compound with molecular formula C18H22 and molecular weight 238.17215 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[1-(3,4-dimethylphenyl)ethyl]-1,2-dimethylbenzene
Also Known As: 1,1-Bis(3,4-dimethylphenyl)ethane, dixylylethane, 3-Ethylthiophene, 1,1-Di-3,4-xylylethane, 4,4'-(Ethane-1,1-diyl)bis(1,2-dimethylbenzene)
Application Areas
Top 5 of 11 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22 |
| Molecular Weight | 238.17215 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 238.17215 Da |
| Heavy Atoms | 18 |
| Complexity | 231.0 |
| SMILES | CC1=C(C=C(C=C1)C(C)C2=CC(=C(C=C2)C)C)C |
| InChIKey | NCSVCMFDHINRJE-UHFFFAOYSA-N |
Chemical Property Profile of 1,1-Bis(3,4-dimethylphenyl)ethane
Property Insights of 1,1-Bis(3,4-dimethylphenyl)ethane
The XLogP value of 5.6 indicates that 1,1-Bis(3,4-dimethylphenyl)ethane 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-Bis(3,4-dimethylphenyl)ethane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Bis(3,4-dimethylphenyl)ethane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1,1-Bis(3,4-dimethylphenyl)ethane?
The CAS number of 1,1-Bis(3,4-dimethylphenyl)ethane is 1742-14-9.
What is the molecular formula of 1,1-Bis(3,4-dimethylphenyl)ethane?
The molecular formula of 1,1-Bis(3,4-dimethylphenyl)ethane is C18H22.
What is the molecular weight of 1,1-Bis(3,4-dimethylphenyl)ethane?
The molecular weight of 1,1-Bis(3,4-dimethylphenyl)ethane is 238.17215 g/mol.
Where can I buy 1,1-Bis(3,4-dimethylphenyl)ethane?
You can request a quote for 1,1-Bis(3,4-dimethylphenyl)ethane directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,1-Bis(3,4-dimethylphenyl)ethane?
Yes, CoreyChem provides custom synthesis services for 1,1-Bis(3,4-dimethylphenyl)ethane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.