2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene
TL;DR: 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene (CAS 116325-74-7) is a chemical compound with molecular formula C8H5BrClF3 and molecular weight 271.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(bromomethyl)-4-chloro-1-(trifluoromethyl)benzene
Also Known As: 5-Chloro-2-(trifluoromethyl)benzyl bromide, 2-(bromomethyl)-4-chloro-1-(trifluoromethyl)benzene, Benzene, 2-(bromomethyl)-4-chloro-1-(trifluoromethyl)-, 5-chloro-2-(trifluoromethyl)benzylbromide, 5-chloro-2-trifluoromethylbenzyl bromide
| Molecular Formula | C8H5BrClF3 |
|---|---|
| Molecular Weight | 271.92 g/mol |
| LogP | 4.2537 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 271.9215 |
| Heavy Atoms | 13 |
| Complexity | 308.7477 |
Chemical Identifiers
| CAS Number | 116325-74-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)CBr)C(F)(F)F |
Product Overview
2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene (CAS 116325-74-7), with molecular formula C8H5BrClF3 and molecular weight 271.92 g/mol. IUPAC: 2-(bromomethyl)-4-chloro-1-(trifluoromethyl)benzene.
Chemical Property Profile of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene
Property Insights of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene
The XLogP value of 4.2537 indicates that 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene 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-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene 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 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene?
The CAS number of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene is 116325-74-7.
What is the molecular formula of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene?
The molecular formula of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene is C8H5BrClF3.
What is the molecular weight of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene?
The molecular weight of 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene is 271.92 g/mol.
Where can I buy 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene?
You can request a quote for 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 2-(Bromomethyl)-4-chloro-1-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.