2-(Methylsulfinyl)phenylboronic acid
TL;DR: 2-(Methylsulfinyl)phenylboronic acid (CAS 850567-97-4) is a chemical compound with molecular formula C7H9BO3S and molecular weight 184.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methylsulfinylphenyl)boronic acid
Also Known As: (2-(Methylsulfinyl)phenyl)boronic acid, 2-(Methylsulfinyl)phenylboronic acid, (2-methylsulfinylphenyl)boronic acid, 2-Methylsulfinylphenylboronic acid, 2-(Methylsulphinyl)benzeneboronic acid
| Molecular Formula | C7H9BO3S |
|---|---|
| Molecular Weight | 184.04 g/mol |
| LogP | -0.8962 |
| Topological Polar Surface Area | 57.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.03654 |
| Heavy Atoms | 12 |
| Complexity | 300.4579 |
Chemical Identifiers
| CAS Number | 850567-97-4 |
|---|---|
| SMILES | B(C1=CC=CC=C1S(=O)C)(O)O |
Product Overview
2-(Methylsulfinyl)phenylboronic acid (CAS 850567-97-4), with molecular formula C7H9BO3S and molecular weight 184.04 g/mol. IUPAC: (2-methylsulfinylphenyl)boronic acid.
Chemical Property Profile of 2-(Methylsulfinyl)phenylboronic acid
Property Insights of 2-(Methylsulfinyl)phenylboronic acid
The XLogP value of -0.8962 indicates that 2-(Methylsulfinyl)phenylboronic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.53 Ų, 2-(Methylsulfinyl)phenylboronic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylsulfinyl)phenylboronic 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-(Methylsulfinyl)phenylboronic acid?
The CAS number of 2-(Methylsulfinyl)phenylboronic acid is 850567-97-4.
What is the molecular formula of 2-(Methylsulfinyl)phenylboronic acid?
The molecular formula of 2-(Methylsulfinyl)phenylboronic acid is C7H9BO3S.
What is the molecular weight of 2-(Methylsulfinyl)phenylboronic acid?
The molecular weight of 2-(Methylsulfinyl)phenylboronic acid is 184.04 g/mol.
Where can I buy 2-(Methylsulfinyl)phenylboronic acid?
You can request a quote for 2-(Methylsulfinyl)phenylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylsulfinyl)phenylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylsulfinyl)phenylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.