2-Bromo-1,3,4-trifluorobenzene
TL;DR: 2-Bromo-1,3,4-trifluorobenzene (CAS 16793-04-7) is a chemical compound with molecular formula C6H2BrF3 and molecular weight 209.9292 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-1,3,4-trifluorobenzene
Also Known As: 2-bromo-1,3,4-trifluorobenzene, 1-Bromo-2,3,6-trifluorobenzene, 2,3,6-Trifluorobromobenzene, Benzene, 2-bromo-1,3,4-trifluoro-, o-bromo-trifluorobenzene
Technical Specifications
| Molecular Formula | C6H2BrF3 |
| Molecular Weight | 209.9292 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 209.9292 Da |
| Heavy Atoms | 10 |
| Complexity | 120.0 |
| SMILES | C1=CC(=C(C(=C1F)F)Br)F |
| InChIKey | CNAXDCSHYHIOGW-UHFFFAOYSA-N |
Chemical Property Profile of 2-Bromo-1,3,4-trifluorobenzene
Property Insights of 2-Bromo-1,3,4-trifluorobenzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-1,3,4-trifluorobenzene. With a topological polar surface area (TPSA) of 0.0 Ų, 2-Bromo-1,3,4-trifluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-1,3,4-trifluorobenzene 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
What is the CAS number of 2-Bromo-1,3,4-trifluorobenzene?
The CAS number of 2-Bromo-1,3,4-trifluorobenzene is 16793-04-7.
What is the molecular formula of 2-Bromo-1,3,4-trifluorobenzene?
The molecular formula of 2-Bromo-1,3,4-trifluorobenzene is C6H2BrF3.
What is the molecular weight of 2-Bromo-1,3,4-trifluorobenzene?
The molecular weight of 2-Bromo-1,3,4-trifluorobenzene is 209.9292 g/mol.
Where can I buy 2-Bromo-1,3,4-trifluorobenzene?
You can request a quote for 2-Bromo-1,3,4-trifluorobenzene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Bromo-1,3,4-trifluorobenzene?
Yes, CoreyChem provides custom synthesis services for 2-Bromo-1,3,4-trifluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.