4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene
TL;DR: 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene (CAS 67515-62-2) is a chemical compound with molecular formula C8H5ClF4 and molecular weight 212.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene
Also Known As: 4-(chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene, 3-trifluoromethyl-4-fluorobenzyl chloride, 4-Fluoro-3-trifluoromethylbenzyl chloride, 3-trifluoromethyl-4-f luorobenzyl chloride, 4-fluoro-3-(trifluoromethyl)benzyl chloride
| Molecular Formula | C8H5ClF4 |
|---|---|
| Molecular Weight | 212.00 g/mol |
| LogP | 3.5833 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 212.00159 |
| Heavy Atoms | 13 |
| Complexity | 305.5026 |
Chemical Identifiers
| CAS Number | 67515-62-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1CCl)C(F)(F)F)F |
Product Overview
4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene (CAS 67515-62-2), with molecular formula C8H5ClF4 and molecular weight 212.00 g/mol. IUPAC: 4-(chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene.
Chemical Property Profile of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene
Property Insights of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene
The XLogP value of 3.5833 indicates that 4-(Chloromethyl)-1-fluoro-2-(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, 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(Chloromethyl)-1-fluoro-2-(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 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene?
The CAS number of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene is 67515-62-2.
What is the molecular formula of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene?
The molecular formula of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene is C8H5ClF4.
What is the molecular weight of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene?
The molecular weight of 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene is 212.00 g/mol.
Where can I buy 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene?
You can request a quote for 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 4-(Chloromethyl)-1-fluoro-2-(trifluoromethyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.