5-Isopropyl-2-methoxyphenylboronic acid
TL;DR: 5-Isopropyl-2-methoxyphenylboronic acid (CAS 216393-63-4) is a chemical compound with molecular formula C10H15BO3 and molecular weight 194.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxy-5-propan-2-ylphenyl)boronic acid
Also Known As: 5-Isopropyl-2-methoxyphenylboronic acid, (5-Isopropyl-2-methoxyphenyl)boronic acid, 5-ISOPROPYL-2-METHOXYBENZENEBORONIC ACID, (2-methoxy-5-propan-2-ylphenyl)boronic acid, RARECHEM AH PB 0083
| Molecular Formula | C10H15BO3 |
|---|---|
| Molecular Weight | 194.11 g/mol |
| LogP | 0.4984 |
| Topological Polar Surface Area | 49.69 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 194.11142 |
| Heavy Atoms | 14 |
| Complexity | 310.23547 |
Chemical Identifiers
| CAS Number | 216393-63-4 |
|---|---|
| SMILES | B(C1=C(C=CC(=C1)C(C)C)OC)(O)O |
Product Overview
5-Isopropyl-2-methoxyphenylboronic acid (CAS 216393-63-4), with molecular formula C10H15BO3 and molecular weight 194.11 g/mol. IUPAC: (2-methoxy-5-propan-2-ylphenyl)boronic acid.
Chemical Property Profile of 5-Isopropyl-2-methoxyphenylboronic acid
Property Insights of 5-Isopropyl-2-methoxyphenylboronic acid
The XLogP value of 0.4984 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Isopropyl-2-methoxyphenylboronic acid. With a topological polar surface area (TPSA) of 49.69 Ų, 5-Isopropyl-2-methoxyphenylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Isopropyl-2-methoxyphenylboronic 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 5-Isopropyl-2-methoxyphenylboronic acid?
The CAS number of 5-Isopropyl-2-methoxyphenylboronic acid is 216393-63-4.
What is the molecular formula of 5-Isopropyl-2-methoxyphenylboronic acid?
The molecular formula of 5-Isopropyl-2-methoxyphenylboronic acid is C10H15BO3.
What is the molecular weight of 5-Isopropyl-2-methoxyphenylboronic acid?
The molecular weight of 5-Isopropyl-2-methoxyphenylboronic acid is 194.11 g/mol.
Where can I buy 5-Isopropyl-2-methoxyphenylboronic acid?
You can request a quote for 5-Isopropyl-2-methoxyphenylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Isopropyl-2-methoxyphenylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Isopropyl-2-methoxyphenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.