2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid
TL;DR: 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid (CAS 50852-54-5) is a chemical compound with molecular formula C14H14O4S and molecular weight 278.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-6-(2-methylphenoxy)benzenesulfonic acid
Also Known As: 2-methyl-6-(2-methylphenoxy)benzenesulfonic acid, Benzenesulfonic acid,methyl(methylphenoxy)- (9CI)
| Molecular Formula | C14H14O4S |
|---|---|
| Molecular Weight | 278.06 g/mol |
| LogP | 3.34244 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 278.06128 |
| Heavy Atoms | 19 |
| Complexity | 705.1359 |
Chemical Identifiers
| CAS Number | 50852-54-5 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)OC2=CC=CC=C2C)S(=O)(=O)O |
Product Overview
2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid (CAS 50852-54-5), with molecular formula C14H14O4S and molecular weight 278.06 g/mol. IUPAC: 2-methyl-6-(2-methylphenoxy)benzenesulfonic acid.
Chemical Property Profile of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid
Property Insights of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid
The XLogP value of 3.34244 indicates that 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid. Following Lipinski's Rule of Five, 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid has 1 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-Methyl-6-(2-methylphenoxy)benzenesulfonic acid?
The CAS number of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid is 50852-54-5.
What is the molecular formula of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid?
The molecular formula of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid is C14H14O4S.
What is the molecular weight of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid?
The molecular weight of 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid is 278.06 g/mol.
Where can I buy 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid?
You can request a quote for 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Methyl-6-(2-methylphenoxy)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.