4-Bromo-2-fluoro-6-nitroaniline
TL;DR: 4-Bromo-2-fluoro-6-nitroaniline (CAS 455-58-3) is a chemical compound with molecular formula C6H4BrFN2O2 and molecular weight 233.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-fluoro-6-nitroaniline
Also Known As: 4-bromo-2-fluoro-6-nitroaniline, 2-Fluoro-4-Bromo-6-Nitroaniline, 4-bromo-2-fluoro-6-nitro-phenylamine, 4-bromo-2fluoro-6-nitroaniline, 4-bromo-6-fluoro-2-nitrophenylamine
| Molecular Formula | C6H4BrFN2O2 |
|---|---|
| Molecular Weight | 233.94 g/mol |
| LogP | 2.0786 |
| Topological Polar Surface Area | 69.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.94402 |
| Heavy Atoms | 12 |
| Complexity | 342.56512 |
Chemical Identifiers
| CAS Number | 455-58-3 |
|---|---|
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])N)F)Br |
Product Overview
4-Bromo-2-fluoro-6-nitroaniline (CAS 455-58-3), with molecular formula C6H4BrFN2O2 and molecular weight 233.94 g/mol. IUPAC: 4-bromo-2-fluoro-6-nitroaniline.
Chemical Property Profile of 4-Bromo-2-fluoro-6-nitroaniline
Property Insights of 4-Bromo-2-fluoro-6-nitroaniline
The XLogP value of 2.0786 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-2-fluoro-6-nitroaniline. The TPSA of 69.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-fluoro-6-nitroaniline. Following Lipinski's Rule of Five, 4-Bromo-2-fluoro-6-nitroaniline has 1 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-Bromo-2-fluoro-6-nitroaniline?
The CAS number of 4-Bromo-2-fluoro-6-nitroaniline is 455-58-3.
What is the molecular formula of 4-Bromo-2-fluoro-6-nitroaniline?
The molecular formula of 4-Bromo-2-fluoro-6-nitroaniline is C6H4BrFN2O2.
What is the molecular weight of 4-Bromo-2-fluoro-6-nitroaniline?
The molecular weight of 4-Bromo-2-fluoro-6-nitroaniline is 233.94 g/mol.
Where can I buy 4-Bromo-2-fluoro-6-nitroaniline?
You can request a quote for 4-Bromo-2-fluoro-6-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-fluoro-6-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-fluoro-6-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.