4-Isopropylphenylboronic acid
TL;DR: 4-Isopropylphenylboronic acid (CAS 16824-54-7) is a chemical compound with molecular formula C9H13BO2 and molecular weight 164.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-propan-2-ylphenyl)boronic acid
Also Known As: 4-Isopropylphenylboronic acid, 4-Isopropylbenzeneboronic Acid, (4-isopropylphenyl)boronic acid, 4-cumylboronic acid, 4-iso-Propylphenylboronic acid
| Molecular Formula | C9H13BO2 |
|---|---|
| Molecular Weight | 164.10 g/mol |
| LogP | 0.4898 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.10086 |
| Heavy Atoms | 12 |
| Complexity | 214.21037 |
Chemical Identifiers
| CAS Number | 16824-54-7 |
|---|---|
| SMILES | B(C1=CC=C(C=C1)C(C)C)(O)O |
Product Overview
4-Isopropylphenylboronic acid (CAS 16824-54-7), with molecular formula C9H13BO2 and molecular weight 164.10 g/mol. IUPAC: (4-propan-2-ylphenyl)boronic acid.
Chemical Property Profile of 4-Isopropylphenylboronic acid
Property Insights of 4-Isopropylphenylboronic acid
The XLogP value of 0.4898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Isopropylphenylboronic acid. With a topological polar surface area (TPSA) of 40.46 Ų, 4-Isopropylphenylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Isopropylphenylboronic 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-Isopropylphenylboronic acid?
The CAS number of 4-Isopropylphenylboronic acid is 16824-54-7.
What is the molecular formula of 4-Isopropylphenylboronic acid?
The molecular formula of 4-Isopropylphenylboronic acid is C9H13BO2.
What is the molecular weight of 4-Isopropylphenylboronic acid?
The molecular weight of 4-Isopropylphenylboronic acid is 164.10 g/mol.
Where can I buy 4-Isopropylphenylboronic acid?
You can request a quote for 4-Isopropylphenylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Isopropylphenylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Isopropylphenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.