2,5-Bis(trifluoromethyl)aniline
TL;DR: 2,5-Bis(trifluoromethyl)aniline (CAS 163105-90-6) is a chemical compound with molecular formula C8H5F6N and molecular weight 229.03262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-bis(trifluoromethyl)aniline
Also Known As: 2,5-Bis(trifluoromethyl)aniline, 2,5-di(trifluoromethyl)aniline, null, 2,5-Bis aniline, Dutasteride Impurity 4
Application Areas
Top 5 of 7 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H5F6N |
| Molecular Weight | 229.03262 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.03262 Da |
| Heavy Atoms | 15 |
| Complexity | 220.0 |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)N)C(F)(F)F |
| InChIKey | XWMVIJUAZAEWIE-UHFFFAOYSA-N |
Chemical Property Profile of 2,5-Bis(trifluoromethyl)aniline
Property Insights of 2,5-Bis(trifluoromethyl)aniline
The XLogP value of 3.0 indicates that 2,5-Bis(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 2,5-Bis(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Bis(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,5-Bis(trifluoromethyl)aniline?
The CAS number of 2,5-Bis(trifluoromethyl)aniline is 163105-90-6.
What is the molecular formula of 2,5-Bis(trifluoromethyl)aniline?
The molecular formula of 2,5-Bis(trifluoromethyl)aniline is C8H5F6N.
What is the molecular weight of 2,5-Bis(trifluoromethyl)aniline?
The molecular weight of 2,5-Bis(trifluoromethyl)aniline is 229.03262 g/mol.
Where can I buy 2,5-Bis(trifluoromethyl)aniline?
You can request a quote for 2,5-Bis(trifluoromethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,5-Bis(trifluoromethyl)aniline?
Yes, CoreyChem provides custom synthesis services for 2,5-Bis(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.