Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt
TL;DR: Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt (CAS 56359-31-0) is a chemical compound with molecular formula C15H10N2O3 and molecular weight 266.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenyl)isoquinolin-2-ium-4-olate
Also Known As: 2-(4-nitrophenyl)isoquinolin-2-ium-4-olate, Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt
| Molecular Formula | C15H10N2O3 |
|---|---|
| Molecular Weight | 266.07 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.06915 |
| Heavy Atoms | 20 |
| Complexity | 350.0 |
Chemical Identifiers
| CAS Number | 56359-31-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=[N+](C=C2[O-])C3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | ZLPYCURXLBHPOO-UHFFFAOYSA-N |
Product Overview
Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt (CAS 56359-31-0), with molecular formula C15H10N2O3 and molecular weight 266.07 g/mol. IUPAC: 2-(4-nitrophenyl)isoquinolin-2-ium-4-olate.
Chemical Property Profile of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt
Property Insights of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt
The XLogP value of 4.0 indicates that Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt. Following Lipinski's Rule of Five, Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt 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 Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt?
The CAS number of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt is 56359-31-0.
What is the molecular formula of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt?
The molecular formula of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt is C15H10N2O3.
What is the molecular weight of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt?
The molecular weight of Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt is 266.07 g/mol.
Where can I buy Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt?
You can request a quote for Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 4-hydroxy-2-(4-nitrophenyl)hydroxide, inner salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.