2-Fluoro-N-(4-fluorobenzyl)aniline
TL;DR: 2-Fluoro-N-(4-fluorobenzyl)aniline (CAS 886791-73-7) is a chemical compound with molecular formula C13H11F2N and molecular weight 219.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-N-[(4-fluorophenyl)methyl]aniline
Also Known As: 2-Fluoro-N-(4-fluorobenzyl)aniline, 4-Fluorobenzylamine, N-(2-fluorophenyl)-, 2-fluoro-N-[(4-fluorophenyl)methyl]aniline
| Molecular Formula | C13H11F2N |
|---|---|
| Molecular Weight | 219.09 g/mol |
| LogP | 3.5769 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.08595 |
| Heavy Atoms | 16 |
| Complexity | 465.61374 |
Chemical Identifiers
| CAS Number | 886791-73-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NCC2=CC=C(C=C2)F)F |
Product Overview
2-Fluoro-N-(4-fluorobenzyl)aniline (CAS 886791-73-7), with molecular formula C13H11F2N and molecular weight 219.09 g/mol. IUPAC: 2-fluoro-N-[(4-fluorophenyl)methyl]aniline.
Chemical Property Profile of 2-Fluoro-N-(4-fluorobenzyl)aniline
Property Insights of 2-Fluoro-N-(4-fluorobenzyl)aniline
The XLogP value of 3.5769 indicates that 2-Fluoro-N-(4-fluorobenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 2-Fluoro-N-(4-fluorobenzyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-N-(4-fluorobenzyl)aniline has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Fluoro-N-(4-fluorobenzyl)aniline?
The CAS number of 2-Fluoro-N-(4-fluorobenzyl)aniline is 886791-73-7.
What is the molecular formula of 2-Fluoro-N-(4-fluorobenzyl)aniline?
The molecular formula of 2-Fluoro-N-(4-fluorobenzyl)aniline is C13H11F2N.
What is the molecular weight of 2-Fluoro-N-(4-fluorobenzyl)aniline?
The molecular weight of 2-Fluoro-N-(4-fluorobenzyl)aniline is 219.09 g/mol.
Where can I buy 2-Fluoro-N-(4-fluorobenzyl)aniline?
You can request a quote for 2-Fluoro-N-(4-fluorobenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-N-(4-fluorobenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-N-(4-fluorobenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.