4-氟苯胺
TL;DR: 4-氟苯胺 (CAS 371-40-4) is a chemical compound with molecular formula C6H6FN and molecular weight 111.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氟苯胺
4-fluoroaniline
Also Known As: 4-FLUOROANILINE, p-Fluoroaniline, 4-Fluorobenzenamine, 1-Amino-4-fluorobenzene, p-Fluorophenylamine
| Molecular Formula | C6H6FN |
|---|---|
| Molecular Weight | 111.05 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 111.04842 |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
| Melting Point | -0.8 °C |
| Boiling Point | 181.5 °C at 760 mmHg |
| Density | 1.1725 at 20.0 °C |
| Solubility | In water, 33 g/L at 20 °C |
| Flash Point | 73.9 °C |
| Vapor Pressure | 1.0 [mmHg] |
| Refractive Index | 1.51954 at 20 °C |
Chemical Identifiers
| CAS Number | 371-40-4 |
|---|---|
| SMILES | C1=CC(=CC=C1N)F |
| InChIKey | KRZCOLNOCZKSDF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-氟苯胺 (CAS 371-40-4), with molecular formula C6H6FN and molecular weight 111.05 g/mol. IUPAC: 4-fluoroaniline.
Chemical Property Profile of 4-氟苯胺
Property Insights of 4-氟苯胺
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-氟苯胺. With a topological polar surface area (TPSA) of 26.0 Ų, 4-氟苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氟苯胺 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 4-氟苯胺?
The CAS number of 4-氟苯胺 is 371-40-4.
What is the molecular formula of 4-氟苯胺?
The molecular formula of 4-氟苯胺 is C6H6FN.
What is the molecular weight of 4-氟苯胺?
The molecular weight of 4-氟苯胺 is 111.05 g/mol.
Where can I buy 4-氟苯胺?
You can request a quote for 4-氟苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氟苯胺?
Yes, KEHONG BIO provides custom synthesis services for 4-氟苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.