5-Fluoro-2-(trifluoromethyl)benzyl bromide
TL;DR: 5-Fluoro-2-(trifluoromethyl)benzyl bromide (CAS 239135-48-9) is a chemical compound with molecular formula C8H5BrF4 and molecular weight 255.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-4-fluoro-1-(trifluoromethyl)benzene
Also Known As: 5-Fluoro-2-(trifluoromethyl)benzyl bromide, 2-(bromomethyl)-4-fluoro-1-(trifluoromethyl)benzene, 1686AB, 2-trifluoromethyl-5-fluorobenzyl bromide, 5-fluoro-2-trifluoromethylbenzyl bromide
| Molecular Formula | C8H5BrF4 |
|---|---|
| Molecular Weight | 255.95 g/mol |
| LogP | 3.7394 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 255.95108 |
| Heavy Atoms | 13 |
| Complexity | 305.5026 |
Chemical Identifiers
| CAS Number | 239135-48-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1F)CBr)C(F)(F)F |
Product Overview
5-Fluoro-2-(trifluoromethyl)benzyl bromide (CAS 239135-48-9), with molecular formula C8H5BrF4 and molecular weight 255.95 g/mol. IUPAC: 2-(bromomethyl)-4-fluoro-1-(trifluoromethyl)benzene.
Chemical Property Profile of 5-Fluoro-2-(trifluoromethyl)benzyl bromide
Property Insights of 5-Fluoro-2-(trifluoromethyl)benzyl bromide
The XLogP value of 3.7394 indicates that 5-Fluoro-2-(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, 5-Fluoro-2-(trifluoromethyl)benzyl bromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-2-(trifluoromethyl)benzyl bromide has 0 hydrogen bond donor(s) and 0 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-Fluoro-2-(trifluoromethyl)benzyl bromide?
The CAS number of 5-Fluoro-2-(trifluoromethyl)benzyl bromide is 239135-48-9.
What is the molecular formula of 5-Fluoro-2-(trifluoromethyl)benzyl bromide?
The molecular formula of 5-Fluoro-2-(trifluoromethyl)benzyl bromide is C8H5BrF4.
What is the molecular weight of 5-Fluoro-2-(trifluoromethyl)benzyl bromide?
The molecular weight of 5-Fluoro-2-(trifluoromethyl)benzyl bromide is 255.95 g/mol.
Where can I buy 5-Fluoro-2-(trifluoromethyl)benzyl bromide?
You can request a quote for 5-Fluoro-2-(trifluoromethyl)benzyl bromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-2-(trifluoromethyl)benzyl bromide?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-2-(trifluoromethyl)benzyl bromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.