(4-Pentylphenyl)boronic acid
TL;DR: (4-Pentylphenyl)boronic acid (CAS 121219-12-3) is a chemical compound with molecular formula C11H17BO2 and molecular weight 192.13216 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-pentylphenyl)boronic acid
Also Known As: (4-pentylphenyl)boronic Acid, 4-n-Pentylphenylboronic acid, 4-Pentylbenzeneboronic acid, 4-Pentylphenylboronic Acid, 4-N-PENTYLBENZENEBORONIC ACID
Technical Specifications
| Molecular Formula | C11H17BO2 |
| Molecular Weight | 192.13216 g/mol |
| XLogP | 1.0991 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.13216 Da |
| Heavy Atoms | 14 |
| Complexity | 142.0 |
| SMILES | B(C1=CC=C(C=C1)CCCCC)(O)O |
| InChIKey | UZRMPSOGFATLJE-UHFFFAOYSA-N |
Chemical Property Profile of (4-Pentylphenyl)boronic acid
Property Insights of (4-Pentylphenyl)boronic acid
The XLogP value of 1.0991 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Pentylphenyl)boronic acid. With a topological polar surface area (TPSA) of 40.5 Ų, (4-Pentylphenyl)boronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Pentylphenyl)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
What is the CAS number of (4-Pentylphenyl)boronic acid?
The CAS number of (4-Pentylphenyl)boronic acid is 121219-12-3.
What is the molecular formula of (4-Pentylphenyl)boronic acid?
The molecular formula of (4-Pentylphenyl)boronic acid is C11H17BO2.
What is the molecular weight of (4-Pentylphenyl)boronic acid?
The molecular weight of (4-Pentylphenyl)boronic acid is 192.13216 g/mol.
Where can I buy (4-Pentylphenyl)boronic acid?
You can request a quote for (4-Pentylphenyl)boronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Pentylphenyl)boronic acid?
Yes, CoreyChem provides custom synthesis services for (4-Pentylphenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.