2-Methoxy-6-(methylthio)phenylboronic acid
TL;DR: 2-Methoxy-6-(methylthio)phenylboronic acid (CAS 1112984-47-0) is a chemical compound with molecular formula C8H11BO3S and molecular weight 198.0522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-methoxy-6-methylsulfanylphenyl)boronic acid
Also Known As: 2-Methoxy-6-(methylthio)phenylboronic acid, (2-Methoxy-6-(methylthio)phenyl)boronic acid, (2-methoxy-6-methylsulfanylphenyl)boronic acid, (2-methoxy-6-methylsulfanyl-phenyl)boronic Acid, 2-METHOXY-6-METHYLTHIOPHENYLBORONIC ACID
Technical Specifications
| Molecular Formula | C8H11BO3S |
| Molecular Weight | 198.0522 g/mol |
| XLogP | 0.0969 |
| Topological Polar Surface Area (TPSA) | 75.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 198.0522 Da |
| Heavy Atoms | 13 |
| Complexity | 156.0 |
| SMILES | B(C1=C(C=CC=C1SC)OC)(O)O |
| InChIKey | HAKDOFJXXGDZPN-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methoxy-6-(methylthio)phenylboronic acid
Property Insights of 2-Methoxy-6-(methylthio)phenylboronic acid
The XLogP value of 0.0969 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methoxy-6-(methylthio)phenylboronic acid. The TPSA of 75.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methoxy-6-(methylthio)phenylboronic acid. Following Lipinski's Rule of Five, 2-Methoxy-6-(methylthio)phenylboronic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Methoxy-6-(methylthio)phenylboronic acid?
The CAS number of 2-Methoxy-6-(methylthio)phenylboronic acid is 1112984-47-0.
What is the molecular formula of 2-Methoxy-6-(methylthio)phenylboronic acid?
The molecular formula of 2-Methoxy-6-(methylthio)phenylboronic acid is C8H11BO3S.
What is the molecular weight of 2-Methoxy-6-(methylthio)phenylboronic acid?
The molecular weight of 2-Methoxy-6-(methylthio)phenylboronic acid is 198.0522 g/mol.
Where can I buy 2-Methoxy-6-(methylthio)phenylboronic acid?
You can request a quote for 2-Methoxy-6-(methylthio)phenylboronic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methoxy-6-(methylthio)phenylboronic acid?
Yes, CoreyChem provides custom synthesis services for 2-Methoxy-6-(methylthio)phenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.