5-Bromo-2-(trifluoromethyl)-1H-imidazole
TL;DR: 5-Bromo-2-(trifluoromethyl)-1H-imidazole (CAS 219534-98-2) is a chemical compound with molecular formula C4H2BrF3N2 and molecular weight 213.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-2-(trifluoromethyl)-1H-imidazole
Also Known As: 5-bromo-2-(trifluoromethyl)-1H-imidazole, Imidazole, 4-bromo-2-trifluoromethyl-, 4-Bromo-2-(trifluoromethyl)-1H-imidazole, 1H-Imidazole, 5-bromo-2-(trifluoromethyl)-, 2-(Trifluoromethyl)-4-bromo-1H-imidazole
| Molecular Formula | C4H2BrF3N2 |
|---|---|
| Molecular Weight | 213.94 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 213.93535 |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
Chemical Identifiers
| CAS Number | 219534-98-2 |
|---|---|
| SMILES | C1=C(NC(=N1)C(F)(F)F)Br |
| InChIKey | GEOYWMVJTKVTAT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Bromo-2-(trifluoromethyl)-1H-imidazole (CAS 219534-98-2), with molecular formula C4H2BrF3N2 and molecular weight 213.94 g/mol. IUPAC: 5-bromo-2-(trifluoromethyl)-1H-imidazole.
Chemical Property Profile of 5-Bromo-2-(trifluoromethyl)-1H-imidazole
Property Insights of 5-Bromo-2-(trifluoromethyl)-1H-imidazole
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromo-2-(trifluoromethyl)-1H-imidazole. With a topological polar surface area (TPSA) of 28.7 Ų, 5-Bromo-2-(trifluoromethyl)-1H-imidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromo-2-(trifluoromethyl)-1H-imidazole 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
Frequently Asked Questions
What is the CAS number of 5-Bromo-2-(trifluoromethyl)-1H-imidazole?
The CAS number of 5-Bromo-2-(trifluoromethyl)-1H-imidazole is 219534-98-2.
What is the molecular formula of 5-Bromo-2-(trifluoromethyl)-1H-imidazole?
The molecular formula of 5-Bromo-2-(trifluoromethyl)-1H-imidazole is C4H2BrF3N2.
What is the molecular weight of 5-Bromo-2-(trifluoromethyl)-1H-imidazole?
The molecular weight of 5-Bromo-2-(trifluoromethyl)-1H-imidazole is 213.94 g/mol.
Where can I buy 5-Bromo-2-(trifluoromethyl)-1H-imidazole?
You can request a quote for 5-Bromo-2-(trifluoromethyl)-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromo-2-(trifluoromethyl)-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromo-2-(trifluoromethyl)-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.