4-硝基氟苯
TL;DR: 4-硝基氟苯 (CAS 350-46-9) is a chemical compound with molecular formula C6H4FNO2 and molecular weight 141.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基氟苯
1-fluoro-4-nitrobenzene
Also Known As: 4-Fluoronitrobenzene, 1-FLUORO-4-NITROBENZENE, p-Fluoronitrobenzene, p-Nitrofluorobenzene, 4-Nitrofluorobenzene
| Molecular Formula | C6H4FNO2 |
|---|---|
| Molecular Weight | 141.02 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 141.02261 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
| Melting Point | 27 °C |
| Boiling Point | 206-207 °C |
| Density | 1.3300 @ 20 °C |
| Solubility | SOL IN ALCOHOL, ETHER; INSOL IN WATER |
| Vapor Pressure | 0.29 [mmHg] |
| Refractive Index | MAX ABSORPTION (ALCOHOL): 212 NM (LOG E= 4.0); 263 NM (LOG E= 3.9); 1.5316 @ 20 °C |
Chemical Identifiers
| CAS Number | 350-46-9 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])F |
| InChIKey | WFQDTOYDVUWQMS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基氟苯 (CAS 350-46-9), with molecular formula C6H4FNO2 and molecular weight 141.02 g/mol. IUPAC: 1-fluoro-4-nitrobenzene.
Chemical Property Profile of 4-硝基氟苯
Property Insights of 4-硝基氟苯
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-硝基氟苯. With a topological polar surface area (TPSA) of 45.8 Ų, 4-硝基氟苯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-硝基氟苯 has 0 hydrogen bond donor(s) and 3 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-硝基氟苯?
The CAS number of 4-硝基氟苯 is 350-46-9.
What is the molecular formula of 4-硝基氟苯?
The molecular formula of 4-硝基氟苯 is C6H4FNO2.
What is the molecular weight of 4-硝基氟苯?
The molecular weight of 4-硝基氟苯 is 141.02 g/mol.
Where can I buy 4-硝基氟苯?
You can request a quote for 4-硝基氟苯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基氟苯?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基氟苯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.