2-Bromo-4-fluoro-6-nitroaniline
TL;DR: 2-Bromo-4-fluoro-6-nitroaniline (CAS 104762-26-7) is a chemical compound with molecular formula C6H4BrFN2O2 and molecular weight 233.94402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-4-fluoro-6-nitroaniline
Also Known As: 2-bromo-4-fluoro-6-nitroaniline, 2-Bromo-4-fluoro-6-nitrobenzenamine, 2-bromo-4-fluoro-6-nitrophenylamine, Benzenamine, 2-bromo-4-fluoro-6-nitro-, 4-fluoro-2-bromo-6-nitroaniline
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H4BrFN2O2 |
| Molecular Weight | 233.94402 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 233.94402 Da |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
| SMILES | C1=C(C=C(C(=C1[N+](=O)[O-])N)Br)F |
| InChIKey | HCYDUPDSEDHSQB-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-4-fluoro-6-nitroaniline
Property Insights of 2-Bromo-4-fluoro-6-nitroaniline
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-4-fluoro-6-nitroaniline. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Bromo-4-fluoro-6-nitroaniline. Following Lipinski's Rule of Five, 2-Bromo-4-fluoro-6-nitroaniline has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Bromo-4-fluoro-6-nitroaniline?
The CAS number of 2-Bromo-4-fluoro-6-nitroaniline is 104762-26-7.
What is the molecular formula of 2-Bromo-4-fluoro-6-nitroaniline?
The molecular formula of 2-Bromo-4-fluoro-6-nitroaniline is C6H4BrFN2O2.
What is the molecular weight of 2-Bromo-4-fluoro-6-nitroaniline?
The molecular weight of 2-Bromo-4-fluoro-6-nitroaniline is 233.94402 g/mol.
Where can I buy 2-Bromo-4-fluoro-6-nitroaniline?
You can request a quote for 2-Bromo-4-fluoro-6-nitroaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-4-fluoro-6-nitroaniline?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-4-fluoro-6-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.