(4-Bromophenyl)boronic acid
TL;DR: (4-Bromophenyl)boronic acid (CAS 5467-74-3) is a chemical compound with molecular formula C6H6BBrO2 and molecular weight 199.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-bromophenyl)boronic acid
Also Known As: 4-Bromophenylboronic acid, (4-Bromophenyl)boronic acid, 4-Bromobenzeneboronic acid, 4-Bromophenylboric acid, p-Bromophenylboric acid
| Molecular Formula | C6H6BBrO2 |
|---|---|
| Molecular Weight | 199.96 g/mol |
| LogP | 0.13 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 199.96442 |
| Heavy Atoms | 10 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 5467-74-3 |
|---|---|
| SMILES | B(C1=CC=C(C=C1)Br)(O)O |
| InChIKey | QBLFZIBJXUQVRF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(4-Bromophenyl)boronic acid (CAS 5467-74-3), with molecular formula C6H6BBrO2 and molecular weight 199.96 g/mol. IUPAC: (4-bromophenyl)boronic acid.
Chemical Property Profile of (4-Bromophenyl)boronic acid
Property Insights of (4-Bromophenyl)boronic acid
The XLogP value of 0.13 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Bromophenyl)boronic acid. With a topological polar surface area (TPSA) of 40.5 Ų, (4-Bromophenyl)boronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Bromophenyl)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 (4-Bromophenyl)boronic acid?
The CAS number of (4-Bromophenyl)boronic acid is 5467-74-3.
What is the molecular formula of (4-Bromophenyl)boronic acid?
The molecular formula of (4-Bromophenyl)boronic acid is C6H6BBrO2.
What is the molecular weight of (4-Bromophenyl)boronic acid?
The molecular weight of (4-Bromophenyl)boronic acid is 199.96 g/mol.
Where can I buy (4-Bromophenyl)boronic acid?
You can request a quote for (4-Bromophenyl)boronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Bromophenyl)boronic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Bromophenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.