4-Amino-N-ethylbenzenesulfonamide

Base Information

• Chemical Name: 4-Amino-N-ethylbenzenesulfonamide
• CAS No.: 1709-53-1
• Molecular Formula: C8H12N2O2S
• Molecular Weight: 200.261
• Hs Code.: 2935009090
• European Community (EC) Number: 672-087-9
• DSSTox Substance ID: DTXSID40343968
• Wikidata: Q82115581
• Mol file: 1709-53-1.mol

Synonyms:4-Amino-N-ethylbenzenesulfonamide;1709-53-1;4-amino-n-ethyl-benzenesulfonamide;N-Ethyl 4-aminobenzenesulfonamide;4-amino-N-ethylbenzene-1-sulfonamide;SCHEMBL923761;DTXSID40343968;4-Amino-N-ethylbenzenesulfonamide #;BBL007980;MFCD02090910;STK288080;Benzenesulfonamide, 4-amino-N-ethyl-;AKOS000141345;AT23141;SB78023;VS-01770;CS-0143136;FT-0678403;EN300-29912;4-amino-N-ethyl-benzenesulfonamide, AldrichCPR;A881971;Z111577334

Chemical Property of 4-Amino-N-ethylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 1.32E-05mmHg at 25°C
• Melting Point: 106 °C
• Boiling Point: 367.9oC at 760 mmHg
• PKA: 12.57±0.50(Predicted)
• Flash Point: 176.3oC
• PSA: 80.57000
• Density: 1.26g/cm3
• LogP: 2.61990
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 200.06194880
• Heavy Atom Count: 13
• Complexity: 237

Purity/Quality:

98%min ^*data from raw suppliers

N-Ethyl 4-aminobenzenesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNS(=O)(=O)C1=CC=C(C=C1)N

Technology Process of 4-Amino-N-ethylbenzenesulfonamide

There total 5 articles about 4-Amino-N-ethylbenzenesulfonamide 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: 95.0%

→ 4-amino-N-ethylbenzenesulfonamide (1709-53-1)

Guidance literature:

Reference yield: 88.0%

4-nitrobenzenesulfonyl ethylamine (28860-08-4) → 4-amino-N-ethylbenzenesulfonamide (1709-53-1)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In methanol; at 25 ℃; under 22502.3 Torr;

DOI:10.1016/j.bmc.2010.06.038

Reference yield:

N-[4-(ethylaminosulfonyl)phenyl]acetamide (349128-19-4) → 4-amino-N-ethylbenzenesulfonamide (1709-53-1)

Guidance literature:

With hydrogenchloride;

upstream raw materials:

N-[4-(ethylaminosulfonyl)phenyl]acetamide

p-acetylaminobenzenesulfonyl chloride

4-nitrobenzenesulfonyl ethylamine

4-Nitrobenzenesulfonyl chloride

Downstream raw materials:

C₉H₁₀N₂O₂S₂

N-(4-(ethylsulfamoyl)phenyl)-3-methyl-D-valyl-(4R)-4-((7-chloro-4-methoxy-1-isoquinolinyl)oxy)-N-((1R,2S)-1-((cyclopropylsulfonyl)carbamoyl)-2-vinylcyclopropyl)-L-prolinamide

N-(4-(ethylsulfamoyl)phenyl)-3-methyl-L-valyl-(4R)-4-((7-chloro-4-methoxy-1-isoquinolinyl)oxy)-N-((1R,2S)-1-((cyclopropylsulfonyl)carbamoyl)-2-vinylcyclopropyl)-L-prolinamide

C₂₇H₃₁N₃O₃S₂

Refernces

• 1、 Li, Cong,Deng, Xiaobing,Zhang, Weilin,Xie, Xiaowen,Conrad, Marcus,Liu, Ying,Angeli, José Pedro Friedmann,Lai, Luhua. "Novel Allosteric Activators for Ferroptosis Regulator Glutathione Peroxidase 4". . p. 266 - 275. Retrieved 2019/01/15.
• 2、 -. "NOVEL ADENOSINE A3 RECEPTOR AGONISTS". Page/Page column 36. . Retrieved 2008/06/13.