4-硝基苯酚钠
TL;DR: 4-硝基苯酚钠 (CAS 824-78-2) is a chemical compound with molecular formula C6H4NNaO3 and molecular weight 161.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-硝基苯酚钠
sodium 4-nitrophenolate
Also Known As: Sodium 4-nitrophenolate, Sodium 4-nitrophenoxide, Sodium p-nitrophenoxide, Sodium nitrophenate, Sodium p-nitrophenol
| Molecular Formula | C6H4NNaO3 |
|---|---|
| Molecular Weight | 161.01 g/mol |
| LogP | -2.33 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 161.00888 |
| Heavy Atoms | 11 |
| Complexity | 123.0 |
| Solubility | SOLUBILITY: 5.97 G/100 CC WATER @ 25 °C /TETRAHYDRATE/ |
Chemical Identifiers
| CAS Number | 824-78-2 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])[O-].[Na+] |
| InChIKey | CURNJKLCYZZBNJ-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-硝基苯酚钠 (CAS 824-78-2), with molecular formula C6H4NNaO3 and molecular weight 161.01 g/mol. IUPAC: sodium 4-nitrophenolate.
Chemical Property Profile of 4-硝基苯酚钠
Property Insights of 4-硝基苯酚钠
The XLogP value of -2.33 indicates that 4-硝基苯酚钠 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-硝基苯酚钠. Following Lipinski's Rule of Five, 4-硝基苯酚钠 has 0 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 4-硝基苯酚钠?
The CAS number of 4-硝基苯酚钠 is 824-78-2.
What is the molecular formula of 4-硝基苯酚钠?
The molecular formula of 4-硝基苯酚钠 is C6H4NNaO3.
What is the molecular weight of 4-硝基苯酚钠?
The molecular weight of 4-硝基苯酚钠 is 161.01 g/mol.
Where can I buy 4-硝基苯酚钠?
You can request a quote for 4-硝基苯酚钠 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-硝基苯酚钠?
Yes, KEHONG BIO provides custom synthesis services for 4-硝基苯酚钠 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.