5-Methyl-4-(4-nitrophenylazo)resorcinol
TL;DR: 5-Methyl-4-(4-nitrophenylazo)resorcinol (CAS 607-96-5) is a chemical compound with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-[(4-nitrophenyl)diazenyl]benzene-1,3-diol
Also Known As: 4-Nitrobenzene-azo-orcinol, Beryllon I, 4-(4-Nitrophenylazo)orcinol, 1,3-Benzenediol, 5-methyl-4-[(4-nitrophenyl)azo]-, 4-(p-Nitrophenylazo)orcinol
| Molecular Formula | C13H11N3O4 |
|---|---|
| Molecular Weight | 273.07 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.07495 |
| Heavy Atoms | 20 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 607-96-5 |
|---|---|
| SMILES | CC1=CC(=CC(=C1N=NC2=CC=C(C=C2)[N+](=O)[O-])O)O |
| InChIKey | XDOOUKIUNUWEFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methyl-4-(4-nitrophenylazo)resorcinol (CAS 607-96-5), with molecular formula C13H11N3O4 and molecular weight 273.07 g/mol. IUPAC: 5-methyl-4-[(4-nitrophenyl)diazenyl]benzene-1,3-diol.
Chemical Property Profile of 5-Methyl-4-(4-nitrophenylazo)resorcinol
Property Insights of 5-Methyl-4-(4-nitrophenylazo)resorcinol
The XLogP value of 3.2 indicates that 5-Methyl-4-(4-nitrophenylazo)resorcinol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Methyl-4-(4-nitrophenylazo)resorcinol. Following Lipinski's Rule of Five, 5-Methyl-4-(4-nitrophenylazo)resorcinol has 2 hydrogen bond donor(s) and 6 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 5-Methyl-4-(4-nitrophenylazo)resorcinol?
The CAS number of 5-Methyl-4-(4-nitrophenylazo)resorcinol is 607-96-5.
What is the molecular formula of 5-Methyl-4-(4-nitrophenylazo)resorcinol?
The molecular formula of 5-Methyl-4-(4-nitrophenylazo)resorcinol is C13H11N3O4.
What is the molecular weight of 5-Methyl-4-(4-nitrophenylazo)resorcinol?
The molecular weight of 5-Methyl-4-(4-nitrophenylazo)resorcinol is 273.07 g/mol.
Where can I buy 5-Methyl-4-(4-nitrophenylazo)resorcinol?
You can request a quote for 5-Methyl-4-(4-nitrophenylazo)resorcinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-4-(4-nitrophenylazo)resorcinol?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-4-(4-nitrophenylazo)resorcinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.