4-(2,2-Difluoroethoxy)benzenamine
TL;DR: 4-(2,2-Difluoroethoxy)benzenamine (CAS 1431965-53-5) is a chemical compound with molecular formula C8H9F2NO and molecular weight 173.06522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2,2-difluoroethoxy)aniline
Also Known As: 4-(2,2-difluoroethoxy)aniline, 4-(2,2-Difluroethoxy)aniline, [4-(2,2-difluoroethoxy)phenyl]amine, 4-(2,2-Difluoroethoxy)benzenamine, beta, beta-Difluoro-p-phenetidine
Technical Specifications
| Molecular Formula | C8H9F2NO |
| Molecular Weight | 173.06522 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.06522 Da |
| Heavy Atoms | 12 |
| Complexity | 124.0 |
| SMILES | C1=CC(=CC=C1N)OCC(F)F |
| InChIKey | LJBLGEVQJBDSGH-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2,2-Difluoroethoxy)benzenamine
Property Insights of 4-(2,2-Difluoroethoxy)benzenamine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2,2-Difluoroethoxy)benzenamine. With a topological polar surface area (TPSA) of 35.3 Ų, 4-(2,2-Difluoroethoxy)benzenamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2,2-Difluoroethoxy)benzenamine 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
What is the CAS number of 4-(2,2-Difluoroethoxy)benzenamine?
The CAS number of 4-(2,2-Difluoroethoxy)benzenamine is 1431965-53-5.
What is the molecular formula of 4-(2,2-Difluoroethoxy)benzenamine?
The molecular formula of 4-(2,2-Difluoroethoxy)benzenamine is C8H9F2NO.
What is the molecular weight of 4-(2,2-Difluoroethoxy)benzenamine?
The molecular weight of 4-(2,2-Difluoroethoxy)benzenamine is 173.06522 g/mol.
Where can I buy 4-(2,2-Difluoroethoxy)benzenamine?
You can request a quote for 4-(2,2-Difluoroethoxy)benzenamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2,2-Difluoroethoxy)benzenamine?
Yes, CoreyChem provides custom synthesis services for 4-(2,2-Difluoroethoxy)benzenamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.