2,5-Dichlorobenzeneboronic acid
TL;DR: 2,5-Dichlorobenzeneboronic acid (CAS 946683-64-3) is a chemical compound with molecular formula C6H5BCl2O2 and molecular weight 189.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dichlorophenyl)boronic acid
Also Known As: 2,5-Dichlorophenylboronic acid, (2,5-dichlorophenyl)boronic Acid, null, 2,5-Dichlorobenzeneboronic Acid, 2,5-Dichlorophenylboronicacid
| Molecular Formula | C6H5BCl2O2 |
|---|---|
| Molecular Weight | 189.98 g/mol |
| LogP | 0.6732 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.97597 |
| Heavy Atoms | 11 |
| Complexity | 264.75925 |
Chemical Identifiers
| CAS Number | 946683-64-3 |
|---|---|
| SMILES | B(C1=C(C=CC(=C1)Cl)Cl)(O)O |
Product Overview
2,5-Dichlorobenzeneboronic acid (CAS 946683-64-3), with molecular formula C6H5BCl2O2 and molecular weight 189.98 g/mol. IUPAC: (2,5-dichlorophenyl)boronic acid.
Chemical Property Profile of 2,5-Dichlorobenzeneboronic acid
Property Insights of 2,5-Dichlorobenzeneboronic acid
The XLogP value of 0.6732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dichlorobenzeneboronic acid. With a topological polar surface area (TPSA) of 40.46 Ų, 2,5-Dichlorobenzeneboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dichlorobenzeneboronic 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 2,5-Dichlorobenzeneboronic acid?
The CAS number of 2,5-Dichlorobenzeneboronic acid is 946683-64-3.
What is the molecular formula of 2,5-Dichlorobenzeneboronic acid?
The molecular formula of 2,5-Dichlorobenzeneboronic acid is C6H5BCl2O2.
What is the molecular weight of 2,5-Dichlorobenzeneboronic acid?
The molecular weight of 2,5-Dichlorobenzeneboronic acid is 189.98 g/mol.
Where can I buy 2,5-Dichlorobenzeneboronic acid?
You can request a quote for 2,5-Dichlorobenzeneboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dichlorobenzeneboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dichlorobenzeneboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.