![2-[4-(Trifluoromethyl)phenyl]benzyl bromide structure](/static/products/167/167021-50-3.webp)
2-[4-(Trifluoromethyl)phenyl]benzyl bromide
TL;DR: 2-[4-(Trifluoromethyl)phenyl]benzyl bromide (CAS 167021-50-3) is a chemical compound with molecular formula C14H10BrF3 and molecular weight 313.9918 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(bromomethyl)-2-[4-(trifluoromethyl)phenyl]benzene
Also Known As: 2-[4-(trifluoromethyl)phenyl]benzyl bromide, 1-(bromomethyl)-2-[4-(trifluoromethyl)phenyl]benzene, 2-(bromomethyl)-4'-(trifluoromethyl)-1,1'-biphenyl
Technical Specifications
| Molecular Formula | C14H10BrF3 |
| Molecular Weight | 313.9918 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.9918 Da |
| Heavy Atoms | 18 |
| Complexity | 256.0 |
| SMILES | C1=CC=C(C(=C1)CBr)C2=CC=C(C=C2)C(F)(F)F |
| InChIKey | FJRRLFDAMZYROV-UHFFFAOYSA-N |
Chemical Property Profile of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide
Property Insights of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide
The XLogP value of 5.0 indicates that 2-[4-(Trifluoromethyl)phenyl]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-[4-(Trifluoromethyl)phenyl]benzyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(Trifluoromethyl)phenyl]benzyl 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-(Trifluoromethyl)phenyl]benzyl bromide?
The CAS number of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide is 167021-50-3.
What is the molecular formula of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide?
The molecular formula of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide is C14H10BrF3.
What is the molecular weight of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide?
The molecular weight of 2-[4-(Trifluoromethyl)phenyl]benzyl bromide is 313.9918 g/mol.
Where can I buy 2-[4-(Trifluoromethyl)phenyl]benzyl bromide?
You can request a quote for 2-[4-(Trifluoromethyl)phenyl]benzyl bromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[4-(Trifluoromethyl)phenyl]benzyl bromide?
Yes, CoreyChem provides custom synthesis services for 2-[4-(Trifluoromethyl)phenyl]benzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.