3-Aminopropane-1-sulfonamide hydrochloride

Base Information

• Chemical Name: 3-Aminopropane-1-sulfonamide hydrochloride
• CAS No.: 104458-33-5
• Molecular Formula: C₃H₁₀N₂O₂S*ClH
• Molecular Weight: 174.652
• European Community (EC) Number: 846-326-4

Synonyms:3-aminopropane-1-sulfonamide hydrochloride;104458-33-5;3-Aminopropane-1-sulfonamide, HCl;3-Aminopropane-1-sulfonamide HCl;3-aminopropane-1-sulfonamide;hydrochloride;1-Propanesulfonamide, 3-amino-, monohydrochloride;SCHEMBL722445;3-Aminopropane-1-sulfonamide,HCl;NQJRBKKDZRPLFE-UHFFFAOYSA-N;MFCD12912951;AKOS026672398;BS-22407;DB-151519;CS-0139340;EN300-51335;C77596;Z744592958

Chemical Property of 3-Aminopropane-1-sulfonamide hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 174.0229765
• Heavy Atom Count: 9
• Complexity: 134

Purity/Quality:

99% ^*data from raw suppliers

3-Aminopropane-1-sulfonamideHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C(CN)CS(=O)(=O)N.Cl
• Uses: 3-Aminopropane-1-sulfonamide Hydrochloride is an intermediate in the preparation of pyrrolopyridinylbenzenesulfonamide compounds as IKK2 inhibitors.

Technology Process of 3-Aminopropane-1-sulfonamide hydrochloride

There total 2 articles about 3-Aminopropane-1-sulfonamide hydrochloride 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: 74.0%

3‐(1,3‐dioxo‐2,3‐dihydro‐1H‐isoindol‐2‐yl)propane‐1‐sulfonamide (6712-89-6) → 3‐aminopropane‐1‐sulfonamide hydrochloride (104458-33-5)

Guidance literature:

3‐(1,3‐dioxo‐2,3‐dihydro‐1H‐isoindol‐2‐yl)propane‐1‐sulfonamide; With hydrazine; In ethanol; water; for 4h; Heating / reflux;

With hydrogenchloride; In water; pH=4;

Reference yield:

2-cyano-ethanesulfonic acid amide (97716-80-8) → 3‐aminopropane‐1‐sulfonamide hydrochloride (104458-33-5)

Guidance literature:

With hydrogenchloride; platinum;

DOI:10.1021/ja01865a053

Reference yield:

4‐(3‐bromo‐4‐fluorophenyl)‐3‐(4‐nitro‐1,2,5‐oxadiazol‐3‐yl)‐4,5‐dihydro‐1,2,4‐oxadiazol‐5‐one (2019140-71-5) + 3‐aminopropane‐1‐sulfonamide hydrochloride (104458-33-5) → 3‐({4‐[4‐(3‐bromo‐4‐fluorophenyl)‐5‐oxo‐4,5‐dihydro‐1,2,4‐oxadiazol‐3‐yl]‐1,2,5‐oxadiazol‐3‐yl}amino)propane‐1‐sulfonamide

Guidance literature:

With triethylamine; In tetrahydrofuran; at 20 ℃; for 2h;

upstream raw materials:

2-cyano-ethanesulfonic acid amide

3‐(1,3‐dioxo‐2,3‐dihydro‐1H‐isoindol‐2‐yl)propane‐1‐sulfonamide

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