4-Hexylphenylboronic Acid
TL;DR: 4-Hexylphenylboronic Acid (CAS 363166-79-4) is a chemical compound with molecular formula C12H19BO2 and molecular weight 206.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-hexylphenyl)boronic acid
Also Known As: 4-Hexylphenylboronic acid, (4-hexylphenyl)boronic Acid, 4-n-Hexylphenylboronic acid, 4-(Hex-1-yl)benzeneboronic acid, 4-HexylphenylboronicAcid
| Molecular Formula | C12H19BO2 |
|---|---|
| Molecular Weight | 206.15 g/mol |
| LogP | 1.4892 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 206.14781 |
| Heavy Atoms | 15 |
| Complexity | 269.45554 |
Chemical Identifiers
| CAS Number | 363166-79-4 |
|---|---|
| SMILES | B(C1=CC=C(C=C1)CCCCCC)(O)O |
Product Overview
4-Hexylphenylboronic Acid (CAS 363166-79-4), with molecular formula C12H19BO2 and molecular weight 206.15 g/mol. IUPAC: (4-hexylphenyl)boronic acid.
Chemical Property Profile of 4-Hexylphenylboronic Acid
Property Insights of 4-Hexylphenylboronic Acid
The XLogP value of 1.4892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Hexylphenylboronic Acid. With a topological polar surface area (TPSA) of 40.46 Ų, 4-Hexylphenylboronic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Hexylphenylboronic 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-Hexylphenylboronic Acid?
The CAS number of 4-Hexylphenylboronic Acid is 363166-79-4.
What is the molecular formula of 4-Hexylphenylboronic Acid?
The molecular formula of 4-Hexylphenylboronic Acid is C12H19BO2.
What is the molecular weight of 4-Hexylphenylboronic Acid?
The molecular weight of 4-Hexylphenylboronic Acid is 206.15 g/mol.
Where can I buy 4-Hexylphenylboronic Acid?
You can request a quote for 4-Hexylphenylboronic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Hexylphenylboronic Acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Hexylphenylboronic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.