2-(Difluoromethoxy)-4-fluoroaniline
TL;DR: 2-(Difluoromethoxy)-4-fluoroaniline (CAS 832740-98-4) is a chemical compound with molecular formula C7H6F3NO and molecular weight 177.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(difluoromethoxy)-4-fluoroaniline
Also Known As: 2-(difluoromethoxy)-4-fluoroaniline, 2-Difluoromethoxy-4-fluoro-phenylamine, 2-Difluoromethoxy-4-fluoroaniline, 2-(difluoromethoxy)-4-fluoro-aniline, 2-(difluoromethoxy)-4-fluorophenylamine
| Molecular Formula | C7H6F3NO |
|---|---|
| Molecular Weight | 177.04 g/mol |
| LogP | 2.0093 |
| Topological Polar Surface Area | 35.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.04015 |
| Heavy Atoms | 12 |
| Complexity | 277.35403 |
Chemical Identifiers
| CAS Number | 832740-98-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)OC(F)F)N |
Product Overview
2-(Difluoromethoxy)-4-fluoroaniline (CAS 832740-98-4), with molecular formula C7H6F3NO and molecular weight 177.04 g/mol. IUPAC: 2-(difluoromethoxy)-4-fluoroaniline.
Chemical Property Profile of 2-(Difluoromethoxy)-4-fluoroaniline
Property Insights of 2-(Difluoromethoxy)-4-fluoroaniline
The XLogP value of 2.0093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Difluoromethoxy)-4-fluoroaniline. With a topological polar surface area (TPSA) of 35.25 Ų, 2-(Difluoromethoxy)-4-fluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Difluoromethoxy)-4-fluoroaniline has 1 hydrogen bond donor(s) and 2 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-(Difluoromethoxy)-4-fluoroaniline?
The CAS number of 2-(Difluoromethoxy)-4-fluoroaniline is 832740-98-4.
What is the molecular formula of 2-(Difluoromethoxy)-4-fluoroaniline?
The molecular formula of 2-(Difluoromethoxy)-4-fluoroaniline is C7H6F3NO.
What is the molecular weight of 2-(Difluoromethoxy)-4-fluoroaniline?
The molecular weight of 2-(Difluoromethoxy)-4-fluoroaniline is 177.04 g/mol.
Where can I buy 2-(Difluoromethoxy)-4-fluoroaniline?
You can request a quote for 2-(Difluoromethoxy)-4-fluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Difluoromethoxy)-4-fluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for 2-(Difluoromethoxy)-4-fluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.