![[2-Chloro-4-(trifluoromethyl)phenyl]boronic acid structure](/static/products/2263/226396-32-3.webp)
[2-Chloro-4-(trifluoromethyl)phenyl]boronic acid
TL;DR: [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid (CAS 226396-32-3) is a chemical compound with molecular formula C7H5BClF3O2 and molecular weight 224.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-chloro-4-(trifluoromethyl)phenyl]boronic acid
Also Known As: 2-Chloro-4-(trifluoromethyl)phenylboronic acid, 2-Chloro-4-trifluoromethylphenylboronic acid, 2-Chloro-4-(trifluoromethyl)benzeneboronic acid, [2-chloro-4-(trifluoromethyl)phenyl]boronic Acid, 2-fluoro-4-iodophenylboronicacid
| Molecular Formula | C7H5BClF3O2 |
|---|---|
| Molecular Weight | 224.00 g/mol |
| LogP | 1.0386 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 224.00232 |
| Heavy Atoms | 14 |
| Complexity | 340.19705 |
Chemical Identifiers
| CAS Number | 226396-32-3 |
|---|---|
| SMILES | B(C1=C(C=C(C=C1)C(F)(F)F)Cl)(O)O |
Product Overview
[2-Chloro-4-(trifluoromethyl)phenyl]boronic acid (CAS 226396-32-3), with molecular formula C7H5BClF3O2 and molecular weight 224.00 g/mol. IUPAC: [2-chloro-4-(trifluoromethyl)phenyl]boronic acid.
Chemical Property Profile of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid
Property Insights of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid
The XLogP value of 1.0386 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid. With a topological polar surface area (TPSA) of 40.46 Ų, [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid has 2 hydrogen bond donor(s) and 2 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-Chloro-4-(trifluoromethyl)phenyl]boronic acid?
The CAS number of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid is 226396-32-3.
What is the molecular formula of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid?
The molecular formula of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid is C7H5BClF3O2.
What is the molecular weight of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid?
The molecular weight of [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid is 224.00 g/mol.
Where can I buy [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid?
You can request a quote for [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid?
Yes, KEHONG BIO provides custom synthesis services for [2-Chloro-4-(trifluoromethyl)phenyl]boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.