2,4,5-Trifluorobenzyl Bromide
TL;DR: 2,4,5-Trifluorobenzyl Bromide (CAS 151411-98-2) is a chemical compound with molecular formula C7H4BrF3 and molecular weight 223.94485 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(bromomethyl)-2,4,5-trifluorobenzene
Also Known As: 2,4,5-Trifluorobenzyl bromide, 1-(Bromomethyl)-2,4,5-trifluorobenzene, 2,4,5-trifluorobenzylbromide, Ensitrelvir intermediate, Intermediates-ZCF02195
Technical Specifications
| Molecular Formula | C7H4BrF3 |
| Molecular Weight | 223.94485 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 223.94485 Da |
| Heavy Atoms | 11 |
| Complexity | 131.0 |
| SMILES | C1=C(C(=CC(=C1F)F)F)CBr |
| InChIKey | GAUXEYCSWSMMFZ-UHFFFAOYSA-N |
Chemical Property Profile of 2,4,5-Trifluorobenzyl Bromide
Property Insights of 2,4,5-Trifluorobenzyl Bromide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,5-Trifluorobenzyl Bromide. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4,5-Trifluorobenzyl Bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4,5-Trifluorobenzyl Bromide 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 2,4,5-Trifluorobenzyl Bromide?
The CAS number of 2,4,5-Trifluorobenzyl Bromide is 151411-98-2.
What is the molecular formula of 2,4,5-Trifluorobenzyl Bromide?
The molecular formula of 2,4,5-Trifluorobenzyl Bromide is C7H4BrF3.
What is the molecular weight of 2,4,5-Trifluorobenzyl Bromide?
The molecular weight of 2,4,5-Trifluorobenzyl Bromide is 223.94485 g/mol.
Where can I buy 2,4,5-Trifluorobenzyl Bromide?
You can request a quote for 2,4,5-Trifluorobenzyl Bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4,5-Trifluorobenzyl Bromide?
Yes, CoreyChem provides custom synthesis services for 2,4,5-Trifluorobenzyl Bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.