2,3-Difluoro-4-(trifluoromethyl)benzyl bromide
TL;DR: 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide (CAS 21321-31-3) is a chemical compound with molecular formula C8H4BrF5 and molecular weight 273.94165 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(bromomethyl)-2,3-difluoro-4-(trifluoromethyl)benzene
Also Known As: 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide, 1-(bromomethyl)-2,3-difluoro-4-(trifluoromethyl)benzene, 2,3-Difluoro-4-(trifluoromethyl)benzyl bromid, 2,3-Difluoro-4-(trifluoromethyl)benzylbromide, Benzene, 1-(bromomethyl)-2,3-difluoro-4-(trifluoromethyl)-
Technical Specifications
| Molecular Formula | C8H4BrF5 |
| Molecular Weight | 273.94165 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.94165 Da |
| Heavy Atoms | 14 |
| Complexity | 193.0 |
| SMILES | C1=CC(=C(C(=C1CBr)F)F)C(F)(F)F |
| InChIKey | CSCQGNZVBJMHGR-UHFFFAOYSA-N |
Chemical Property Profile of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide
Property Insights of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide
The XLogP value of 3.6 indicates that 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide?
The CAS number of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide is 21321-31-3.
What is the molecular formula of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide?
The molecular formula of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide is C8H4BrF5.
What is the molecular weight of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide?
The molecular weight of 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide is 273.94165 g/mol.
Where can I buy 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide?
You can request a quote for 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide?
Yes, CoreyChem provides custom synthesis services for 2,3-Difluoro-4-(trifluoromethyl)benzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.