3,5-二硝基水杨酸单钠盐
TL;DR: 3,5-二硝基水杨酸单钠盐 (CAS 46506-88-1) is a chemical compound with molecular formula C7H3N2NaO7 and molecular weight 249.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-二硝基水杨酸单钠盐
sodium 2-carboxy-4,6-dinitrophenolate
Also Known As: Sodium 3,5-dinitrosalicylate, sodium 2-hydroxy-3,5-dinitrobenzoate, 3,5-Dinitrosalicylic acid sodium, Sodium 3,5-dinitrosalicylic acid, 3,5-DINITROSALICYLIC ACID
| Molecular Formula | C7H3N2NaO7 |
|---|---|
| Molecular Weight | 249.98 g/mol |
| LogP | -2.7212 |
| Topological Polar Surface Area | 152.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 249.9838 |
| Heavy Atoms | 17 |
| Complexity | 320.0 |
Chemical Identifiers
| CAS Number | 46506-88-1 |
|---|---|
| SMILES | C1=C(C=C(C(=C1C(=O)O)[O-])[N+](=O)[O-])[N+](=O)[O-].[Na+] |
| InChIKey | VKSMGADJZIODFU-UHFFFAOYSA-M |
Product Overview
3,5-二硝基水杨酸单钠盐 (CAS 46506-88-1), with molecular formula C7H3N2NaO7 and molecular weight 249.98 g/mol. IUPAC: sodium 2-carboxy-4,6-dinitrophenolate.
Chemical Property Profile of 3,5-二硝基水杨酸单钠盐
Property Insights of 3,5-二硝基水杨酸单钠盐
The XLogP value of -2.7212 indicates that 3,5-二硝基水杨酸单钠盐 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 152.0 Ų indicates high polarity, suggesting 3,5-二硝基水杨酸单钠盐 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,5-二硝基水杨酸单钠盐 has 1 hydrogen bond donor(s) and 7 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 3,5-二硝基水杨酸单钠盐?
The CAS number of 3,5-二硝基水杨酸单钠盐 is 46506-88-1.
What is the molecular formula of 3,5-二硝基水杨酸单钠盐?
The molecular formula of 3,5-二硝基水杨酸单钠盐 is C7H3N2NaO7.
What is the molecular weight of 3,5-二硝基水杨酸单钠盐?
The molecular weight of 3,5-二硝基水杨酸单钠盐 is 249.98 g/mol.
Where can I buy 3,5-二硝基水杨酸单钠盐?
You can request a quote for 3,5-二硝基水杨酸单钠盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-二硝基水杨酸单钠盐?
Yes, KEHONG BIO provides custom synthesis services for 3,5-二硝基水杨酸单钠盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.