Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate
TL;DR: Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate (CAS 35379-88-5) is a chemical compound with molecular formula C7H7NO6S and molecular weight 233.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hydroxy-5-methyl-3-nitrobenzenesulfonic acid
Also Known As: 4-hydroxy-5-nitro-toluene-3-sulfonic acid, 2-hydroxy-5-methyl-3-nitrobenzenesulfonic acid, 2-hydroxy-5-methyl-3-nitro-benzenesulfonic Acid, potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate
| Molecular Formula | C7H7NO6S |
|---|---|
| Molecular Weight | 233.00 g/mol |
| LogP | 0.85552 |
| Topological Polar Surface Area | 117.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.9994 |
| Heavy Atoms | 15 |
| Complexity | 520.5271 |
Chemical Identifiers
| CAS Number | 35379-88-5 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)S(=O)(=O)O)O)[N+](=O)[O-] |
Product Overview
Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate (CAS 35379-88-5), with molecular formula C7H7NO6S and molecular weight 233.00 g/mol. IUPAC: 2-hydroxy-5-methyl-3-nitrobenzenesulfonic acid.
Chemical Property Profile of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate
Property Insights of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate
The XLogP value of 0.85552 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate. The TPSA of 117.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate. Following Lipinski's Rule of Five, Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate 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 Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate?
The CAS number of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate is 35379-88-5.
What is the molecular formula of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate?
The molecular formula of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate is C7H7NO6S.
What is the molecular weight of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate?
The molecular weight of Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate is 233.00 g/mol.
Where can I buy Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate?
You can request a quote for Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Potassium 2-hydroxy-5-methyl-3-nitrobenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.