(2,4,6-Trimethylphenyl)sulfonylboronic acid
TL;DR: (2,4,6-Trimethylphenyl)sulfonylboronic acid (CAS 1027309-00-7) is a chemical compound with molecular formula C9H13BO4S and molecular weight 228.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4,6-trimethylphenyl)sulfonylboronic acid
Also Known As: 2,4,6-trimethylsulfonylboronic acid, (2,4,6-trimethylphenyl)sulfonylboronic acid
| Molecular Formula | C9H13BO4S |
|---|---|
| Molecular Weight | 228.06 g/mol |
| LogP | 0.35506 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.06276 |
| Heavy Atoms | 15 |
| Complexity | 455.88086 |
Chemical Identifiers
| CAS Number | 1027309-00-7 |
|---|---|
| SMILES | B(O)(O)S(=O)(=O)C1=C(C=C(C=C1C)C)C |
Product Overview
(2,4,6-Trimethylphenyl)sulfonylboronic acid (CAS 1027309-00-7), with molecular formula C9H13BO4S and molecular weight 228.06 g/mol. IUPAC: (2,4,6-trimethylphenyl)sulfonylboronic acid.
Chemical Property Profile of (2,4,6-Trimethylphenyl)sulfonylboronic acid
Property Insights of (2,4,6-Trimethylphenyl)sulfonylboronic acid
The XLogP value of 0.35506 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2,4,6-Trimethylphenyl)sulfonylboronic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (2,4,6-Trimethylphenyl)sulfonylboronic acid. Following Lipinski's Rule of Five, (2,4,6-Trimethylphenyl)sulfonylboronic 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
Frequently Asked Questions
What is the CAS number of (2,4,6-Trimethylphenyl)sulfonylboronic acid?
The CAS number of (2,4,6-Trimethylphenyl)sulfonylboronic acid is 1027309-00-7.
What is the molecular formula of (2,4,6-Trimethylphenyl)sulfonylboronic acid?
The molecular formula of (2,4,6-Trimethylphenyl)sulfonylboronic acid is C9H13BO4S.
What is the molecular weight of (2,4,6-Trimethylphenyl)sulfonylboronic acid?
The molecular weight of (2,4,6-Trimethylphenyl)sulfonylboronic acid is 228.06 g/mol.
Where can I buy (2,4,6-Trimethylphenyl)sulfonylboronic acid?
You can request a quote for (2,4,6-Trimethylphenyl)sulfonylboronic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2,4,6-Trimethylphenyl)sulfonylboronic acid?
Yes, KEHONG BIO provides custom synthesis services for (2,4,6-Trimethylphenyl)sulfonylboronic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.