2-amino-N,N-dimethylethanesulfonamide

Base Information

• Chemical Name: 2-amino-N,N-dimethylethanesulfonamide
• CAS No.: 91893-70-8
• Molecular Formula: C4H12 N2 O2 S
• Molecular Weight: 152.22
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID90600417
• Wikidata: Q72436270
• Mol file: 91893-70-8.mol

Synonyms:2-amino-N,N-dimethylethanesulfonamide;91893-70-8;2-Amino-N,N-dimethylethane-1-sulfonamide;SCHEMBL1879547;DTXSID90600417;RTVWJWNJHGNHTD-UHFFFAOYSA-N;BBL031232;MFCD09041898;STK503450;AKOS000124323;AS-63285;DA-00908;CS-0088482;EN300-197740;W13725

Chemical Property of 2-amino-N,N-dimethylethanesulfonamide

Chemical Property:

• Vapor Pressure: 0.03mmHg at 25°C
• Refractive Index: 1.494
• Boiling Point: 244.6°C at 760 mmHg
• PKA: 8.11±0.10(Predicted)
• Flash Point: 101.7°C
• PSA: 71.78000
• Density: 1.203g/cm³
• LogP: 0.61760
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: -1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 152.06194880
• Heavy Atom Count: 9
• Complexity: 156

Purity/Quality:

97% ^*data from raw suppliers

2-Amino-N,N-dimethylethanesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)S(=O)(=O)CCN

Technology Process of 2-amino-N,N-dimethylethanesulfonamide

There total 2 articles about 2-amino-N,N-dimethylethanesulfonamide 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: 63.0%

2-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)ethanesulfonic acid dimethylamide (81428-07-1) → 2-aminoethanesulfonic acid dimethylamide (91893-70-8)

Guidance literature:

With hydrazine hydrate; In methanol; Heating;

DOI:10.1021/jm070314y

Reference yield:

→ 2-aminoethanesulfonic acid dimethylamide (91893-70-8)

Guidance literature:

With ethanol; hydrazine hydrate; Erwaermen des Reaktionsprodukts mit verd.wss.HCl;

DOI:10.1021/jo01166a014 DOI:10.1021/ja01198a047

Reference yield:

2-aminoethanesulfonic acid dimethylamide (91893-70-8) + N-(4-chlorobenzyl)-1,6-dioxo-1,3,4,6-tetrahydropyrido[2,1-c][1,4]oxazine-7-carboxamide → N5-(4-chlorobenzyl)-N2-(2-(N,N-dimethylsulfamoyl)ethyl)-1-(2-hydroxyethyl)-6-oxo-1,6-dihydropyridine-2,5-dicarboxamide

Guidance literature:

In acetonitrile; at 100 - 120 ℃; for 1.5h; Microwave irradiation; Sealed tube;

upstream raw materials:

2-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)ethanesulfonic acid dimethylamide

Downstream raw materials:

(2S,4S)-4-Acetylsulfanyl-2-(2-dimethylsulfamoyl-ethylcarbamoyl)-pyrrolidine-1-carboxylic acid 4-nitro-benzyl ester

5(S)-tert-butoxycarbonylamino-4(S)-hydroxy-7(S)-isopropyl-2(R)-methyl-8-[4-methoxy-3-(3-methoxypropyloxy)-phenyl]-octanoic acid {N-[2-(N,N-dimethylsulfonyl)-ethyl]} amide