4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid
TL;DR: 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid (CAS 78659-97-9) is a chemical compound with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4-hydroxy-3-methylphenyl)diazenyl]benzenesulfonic acid
Also Known As: 4-(3-methyl-4-hydroxyphenylazo)benzenesulfonic acid, 4-(4-Hydroxy-3-methylphenylazo)benzenesulfonic acid, 4-[2-(4-hydroxy-3-methylphenyl)diazen-1-yl]benzene-1-sulfonic acid, 4-[(E)-2-(4-hydroxy-3-methylphenyl)diazen-1-yl]benzene-1-sulfonic acid, 4-[(2E)-2-(3-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazinyl]benzenesulfonic acid
| Molecular Formula | C13H12N2O4S |
|---|---|
| Molecular Weight | 292.05 g/mol |
| LogP | 3.36272 |
| Topological Polar Surface Area | 99.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 292.0518 |
| Heavy Atoms | 20 |
| Complexity | 752.4407 |
Chemical Identifiers
| CAS Number | 78659-97-9 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)N=NC2=CC=C(C=C2)S(=O)(=O)O)O |
Product Overview
4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid (CAS 78659-97-9), with molecular formula C13H12N2O4S and molecular weight 292.05 g/mol. IUPAC: 4-[(4-hydroxy-3-methylphenyl)diazenyl]benzenesulfonic acid.
Chemical Property Profile of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid
Property Insights of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid
The XLogP value of 3.36272 indicates that 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.32 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid. Following Lipinski's Rule of Five, 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid has 2 hydrogen bond donor(s) and 5 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 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid?
The CAS number of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid is 78659-97-9.
What is the molecular formula of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid?
The molecular formula of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid is C13H12N2O4S.
What is the molecular weight of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid?
The molecular weight of 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid is 292.05 g/mol.
Where can I buy 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid?
You can request a quote for 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(3-Methyl-4-hydroxyphenylazo)benzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.