2-Butoxy-5-methylphenylboronic acid
TL;DR: 2-Butoxy-5-methylphenylboronic acid (CAS 480438-72-0) is a chemical compound with molecular formula C11H17BO3 and molecular weight 208.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-butoxy-5-methylphenyl)boronic acid
Also Known As: 2-Butoxy-5-methylphenylboronic acid, (2-butoxy-5-methylphenyl)boronic acid, 2-Butoxy-5-methylphenylboronicacid, (2-butoxy-5-methyl-phenyl)boronic Acid, A-BUTOXY-5-METHYLPHENYLBORONIC ACID
| Molecular Formula | C11H17BO3 |
|---|---|
| Molecular Weight | 208.13 g/mol |
| LogP | 0.85372 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 208.12708 |
| Heavy Atoms | 15 |
| Complexity | 312.7014 |
Chemical Identifiers
| CAS Number | 480438-72-0 |
|---|---|
| SMILES | B(C1=C(C=CC(=C1)C)OCCCC)(O)O |
Product Overview
2-Butoxy-5-methylphenylboronic acid (CAS 480438-72-0), with molecular formula C11H17BO3 and molecular weight 208.13 g/mol. IUPAC: (2-butoxy-5-methylphenyl)boronic acid.
Chemical Property Profile of 2-Butoxy-5-methylphenylboronic acid
Property Insights of 2-Butoxy-5-methylphenylboronic acid
The XLogP value of 0.85372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butoxy-5-methylphenylboronic acid. With a topological polar surface area (TPSA) of 49.69 Ų, 2-Butoxy-5-methylphenylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butoxy-5-methylphenylboronic acid has 2 hydrogen bond donor(s) and 3 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 2-Butoxy-5-methylphenylboronic acid?
The CAS number of 2-Butoxy-5-methylphenylboronic acid is 480438-72-0.
What is the molecular formula of 2-Butoxy-5-methylphenylboronic acid?
The molecular formula of 2-Butoxy-5-methylphenylboronic acid is C11H17BO3.
What is the molecular weight of 2-Butoxy-5-methylphenylboronic acid?
The molecular weight of 2-Butoxy-5-methylphenylboronic acid is 208.13 g/mol.
Where can I buy 2-Butoxy-5-methylphenylboronic acid?
You can request a quote for 2-Butoxy-5-methylphenylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butoxy-5-methylphenylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Butoxy-5-methylphenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.