2-Chloro-5-Trifluoromethoxyphenylboronic Acid
TL;DR: 2-Chloro-5-Trifluoromethoxyphenylboronic Acid (CAS 182344-18-9) is a chemical compound with molecular formula C7H5BClF3O3 and molecular weight 240.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-chloro-5-(trifluoromethoxy)phenyl]boronic acid
Also Known As: 2-Chloro-5-(trifluoromethoxy)phenylboronic acid, (2-Chloro-5-(trifluoromethoxy)phenyl)boronic acid, [2-chloro-5-(trifluoromethoxy)phenyl]boronic Acid, 2-Chloro-5-trifluoromethoxyphenylboronic acid, 4-HYDROXYL(1H)INDAZOLE
| Molecular Formula | C7H5BClF3O3 |
|---|---|
| Molecular Weight | 240.00 g/mol |
| LogP | 0.9184 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.99724 |
| Heavy Atoms | 15 |
| Complexity | 355.8239 |
Chemical Identifiers
| CAS Number | 182344-18-9 |
|---|---|
| SMILES | B(C1=C(C=CC(=C1)OC(F)(F)F)Cl)(O)O |
Product Overview
2-Chloro-5-Trifluoromethoxyphenylboronic Acid (CAS 182344-18-9), with molecular formula C7H5BClF3O3 and molecular weight 240.00 g/mol. IUPAC: [2-chloro-5-(trifluoromethoxy)phenyl]boronic acid.
Chemical Property Profile of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid
Property Insights of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid
The XLogP value of 0.9184 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5-Trifluoromethoxyphenylboronic Acid. With a topological polar surface area (TPSA) of 49.69 Ų, 2-Chloro-5-Trifluoromethoxyphenylboronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-5-Trifluoromethoxyphenylboronic Acid has 2 hydrogen bond donor(s) and 3 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-5-Trifluoromethoxyphenylboronic Acid?
The CAS number of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid is 182344-18-9.
What is the molecular formula of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid?
The molecular formula of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid is C7H5BClF3O3.
What is the molecular weight of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid?
The molecular weight of 2-Chloro-5-Trifluoromethoxyphenylboronic Acid is 240.00 g/mol.
Where can I buy 2-Chloro-5-Trifluoromethoxyphenylboronic Acid?
You can request a quote for 2-Chloro-5-Trifluoromethoxyphenylboronic 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-5-Trifluoromethoxyphenylboronic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5-Trifluoromethoxyphenylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.