N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline
TL;DR: N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline (CAS 1024247-14-0) is a chemical compound with molecular formula C14H11F4N and molecular weight 269.08276 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2-fluorophenyl)methyl]-2-(trifluoromethyl)aniline
Also Known As: N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline, Benzeneethanamine, N-(4-phenoxyphenyl)-, N-[(2-fluorophenyl)methyl]-2-(trifluoromethyl)aniline
Technical Specifications
| Molecular Formula | C14H11F4N |
| Molecular Weight | 269.08276 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.08276 Da |
| Heavy Atoms | 19 |
| Complexity | 279.0 |
| SMILES | C1=CC=C(C(=C1)CNC2=CC=CC=C2C(F)(F)F)F |
| InChIKey | ASCPOHCDSLZUJZ-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline
Property Insights of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline
The XLogP value of 4.4 indicates that N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.0 Ų, N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline?
The CAS number of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline is 1024247-14-0.
What is the molecular formula of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline?
The molecular formula of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline is C14H11F4N.
What is the molecular weight of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline?
The molecular weight of N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline is 269.08276 g/mol.
Where can I buy N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline?
You can request a quote for N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline?
Yes, CoreyChem provides custom synthesis services for N-(2-Fluorobenzyl)-2-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.