(4-Propylphenyl)boronic acid
TL;DR: (4-Propylphenyl)boronic acid (CAS 1359844-00-0) is a chemical compound with molecular formula C9H13BO2 and molecular weight 164.10086 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-propylphenyl)boronic acid
Also Known As: 4-Propylphenylboronic acid, (4-propylphenyl)boronic Acid, 4-(Propyl)benzeneboronic acid, 4-propylbenzeneboronic acid, 4-Propylphenylboronicacid
Technical Specifications
| Molecular Formula | C9H13BO2 |
| Molecular Weight | 164.10086 g/mol |
| XLogP | 0.3189 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.10086 Da |
| Heavy Atoms | 12 |
| Complexity | 120.0 |
| SMILES | B(C1=CC=C(C=C1)CCC)(O)O |
| InChIKey | WLCGYIWOKVWFLB-UHFFFAOYSA-N |
Chemical Property Profile of (4-Propylphenyl)boronic acid
Property Insights of (4-Propylphenyl)boronic acid
The XLogP value of 0.3189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Propylphenyl)boronic acid. With a topological polar surface area (TPSA) of 40.5 Ų, (4-Propylphenyl)boronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (4-Propylphenyl)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-Propylphenyl)boronic acid?
The CAS number of (4-Propylphenyl)boronic acid is 1359844-00-0.
What is the molecular formula of (4-Propylphenyl)boronic acid?
The molecular formula of (4-Propylphenyl)boronic acid is C9H13BO2.
What is the molecular weight of (4-Propylphenyl)boronic acid?
The molecular weight of (4-Propylphenyl)boronic acid is 164.10086 g/mol.
Where can I buy (4-Propylphenyl)boronic acid?
You can request a quote for (4-Propylphenyl)boronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Propylphenyl)boronic acid?
Yes, CoreyChem provides custom synthesis services for (4-Propylphenyl)boronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.