2,5-Difluoro-n-(3-fluorophenyl)aniline
TL;DR: 2,5-Difluoro-n-(3-fluorophenyl)aniline (CAS 5299-71-8) is a chemical compound with molecular formula C12H8F3N and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-difluoro-N-(3-fluorophenyl)aniline
Also Known As: 2,5-difluoro-n-(3-fluorophenyl)aniline, (2,5-difluoro-phenyl)-(3-fluoro-phenyl)-amine
| Molecular Formula | C12H8F3N |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.06088 |
| Heavy Atoms | 16 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 5299-71-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)NC2=C(C=CC(=C2)F)F |
| InChIKey | NQONWNLMAUFKLH-UHFFFAOYSA-N |
Product Overview
2,5-Difluoro-n-(3-fluorophenyl)aniline (CAS 5299-71-8), with molecular formula C12H8F3N and molecular weight 223.06 g/mol. IUPAC: 2,5-difluoro-N-(3-fluorophenyl)aniline.
Chemical Property Profile of 2,5-Difluoro-n-(3-fluorophenyl)aniline
Property Insights of 2,5-Difluoro-n-(3-fluorophenyl)aniline
The XLogP value of 3.8 indicates that 2,5-Difluoro-n-(3-fluorophenyl)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, 2,5-Difluoro-n-(3-fluorophenyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Difluoro-n-(3-fluorophenyl)aniline has 1 hydrogen bond donor(s) and 4 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 2,5-Difluoro-n-(3-fluorophenyl)aniline?
The CAS number of 2,5-Difluoro-n-(3-fluorophenyl)aniline is 5299-71-8.
What is the molecular formula of 2,5-Difluoro-n-(3-fluorophenyl)aniline?
The molecular formula of 2,5-Difluoro-n-(3-fluorophenyl)aniline is C12H8F3N.
What is the molecular weight of 2,5-Difluoro-n-(3-fluorophenyl)aniline?
The molecular weight of 2,5-Difluoro-n-(3-fluorophenyl)aniline is 223.06 g/mol.
Where can I buy 2,5-Difluoro-n-(3-fluorophenyl)aniline?
You can request a quote for 2,5-Difluoro-n-(3-fluorophenyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Difluoro-n-(3-fluorophenyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Difluoro-n-(3-fluorophenyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.