N,N-Dimethyl-4-fluoroaniline
TL;DR: N,N-Dimethyl-4-fluoroaniline (CAS 194086-70-9) is a chemical compound with molecular formula CN(C)C1=CC=C(C=C1)F and molecular weight 139.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-N,N-dimethylaniline
Also Known As: 4-Fluoro-N,N-dimethylaniline, N,N-Dimethyl-4-fluoroaniline, p-Fluoro-N,N-dimethylaniline, 4-fluoro-N,N-dimethyl-aniline, N,N-Dimethyl-p-fluoroaniline
| Molecular Formula | CN(C)C1=CC=C(C=C1)F |
|---|---|
| Molecular Weight | 139.08 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 139.07973 |
| Heavy Atoms | 10 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 194086-70-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)F |
| InChIKey | YJEHCGOJNJUOII-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-Dimethyl-4-fluoroaniline (CAS 194086-70-9), with molecular formula CN(C)C1=CC=C(C=C1)F and molecular weight 139.08 g/mol. IUPAC: 4-fluoro-N,N-dimethylaniline.
Chemical Property Profile of N,N-Dimethyl-4-fluoroaniline
Property Insights of N,N-Dimethyl-4-fluoroaniline
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Dimethyl-4-fluoroaniline. With a topological polar surface area (TPSA) of 3.2 Ų, N,N-Dimethyl-4-fluoroaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Dimethyl-4-fluoroaniline has 0 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 N,N-Dimethyl-4-fluoroaniline?
The CAS number of N,N-Dimethyl-4-fluoroaniline is 194086-70-9.
What is the molecular formula of N,N-Dimethyl-4-fluoroaniline?
The molecular formula of N,N-Dimethyl-4-fluoroaniline is CN(C)C1=CC=C(C=C1)F.
What is the molecular weight of N,N-Dimethyl-4-fluoroaniline?
The molecular weight of N,N-Dimethyl-4-fluoroaniline is 139.08 g/mol.
Where can I buy N,N-Dimethyl-4-fluoroaniline?
You can request a quote for N,N-Dimethyl-4-fluoroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Dimethyl-4-fluoroaniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-Dimethyl-4-fluoroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.