N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline
TL;DR: N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline (CAS 133229-88-6) is a chemical compound with molecular formula C14H4BrCl2F6N3O4 and molecular weight 540.86664 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-bromo-6-chloro-4-(trifluoromethyl)phenyl]-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline
Also Known As: N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline, N-[2-bromo-6-chloro-4-(trifluoromethyl)phenyl]-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline, 3-Chloro-4-trifluoromethyl-2,6-dinitro-N-[2-bromo-6-chloro-4-trifluoromethylphenyl]benzenamine
Technical Specifications
| Molecular Formula | C14H4BrCl2F6N3O4 |
| Molecular Weight | 540.86664 g/mol |
| XLogP | 7.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 2 |
| Exact Mass | 540.86664 Da |
| Heavy Atoms | 30 |
| Complexity | 662.0 |
| SMILES | C1=C(C=C(C(=C1Cl)NC2=C(C=C(C(=C2[N+](=O)[O-])Cl)C(F)(F)F)[N+](=O)[O-])Br)C(F)(F)F |
| InChIKey | ZQQNSGQLQSENKR-UHFFFAOYSA-N |
Chemical Property Profile of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline
Property Insights of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline
The XLogP value of 7.4 indicates that N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline. Following Lipinski's Rule of Five, N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline has 1 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline?
The CAS number of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline is 133229-88-6.
What is the molecular formula of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline?
The molecular formula of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline is C14H4BrCl2F6N3O4.
What is the molecular weight of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline?
The molecular weight of N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline is 540.86664 g/mol.
Where can I buy N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline?
You can request a quote for N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline?
Yes, CoreyChem provides custom synthesis services for N-(2-Bromo-6-chloro-4-(trifluoromethyl)phenyl)-3-chloro-2,6-dinitro-4-(trifluoromethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.