8-Hydroxy-7-iodoquinolin-1-ium-5-sulfonate

Base Information

• Chemical Name: 8-Hydroxy-7-iodoquinolin-1-ium-5-sulfonate
• CAS No.: 547-91-1
• Molecular Formula: C9H6 I N O4 S
• Molecular Weight: 351.121
• Hs Code.: 2933499090
• Metabolomics Workbench ID: 144336
• Mol file: 547-91-1.mol

Synonyms:

Chemical Property of 8-Hydroxy-7-iodoquinolin-1-ium-5-sulfonate

Chemical Property:

• Appearance/Colour: yellow-green powder
• Melting Point: 269-270 ºC
• PKA: pK1:2.514;pK2:7.417 (25°C)
• PSA: 95.87000
• Density: 2.193g/cm3
• LogP: 2.87250
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 350.90623
• Heavy Atom Count: 16
• Complexity: 342

Purity/Quality:

98% ^*data from raw suppliers

8-Hydroxy-7-iodoquinoline-5-sulfonic Acid ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 34
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1=CC2=C(C(=C(C=C2S(=O)(=O)[O-])I)O)[NH+]=C1

Technology Process of 8-Hydroxy-7-iodoquinolin-1-ium-5-sulfonate

There total 3 articles about 8-Hydroxy-7-iodoquinolin-1-ium-5-sulfonate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ 8-hydroxy-7-iodo-quinoline-5-sulfonic acid (547-91-1)

Guidance literature:

With hydrogenchloride; potassium iodide; calcium chloride;

Reference yield:

8-quinolinol-5-sulfonic acid (84-88-8) → 8-hydroxy-7-iodo-quinoline-5-sulfonic acid (547-91-1)

Guidance literature:

With sodium hydrogencarbonate; Erwaermen des Reaktionsgemisches mit Jod;

Reference yield:

→ 8-hydroxy-7-iodo-quinoline-5-sulfonic acid (547-91-1)

Guidance literature:

8-Hydroxy-chinolin-5-sulfonsaeure, I2 in wss. KI/I;

upstream raw materials:

8-quinolinol-5-sulfonic acid

Downstream raw materials:

7-Iodo-8-(2-oxo-2-phenyl-ethoxy)-quinoline-5-sulfonic acid