N-Ethylbenzenesulfonamide

Base Information

• Chemical Name: N-Ethylbenzenesulfonamide
• CAS No.: 5339-67-3
• Molecular Formula: C8H11 N O2 S
• Molecular Weight: 185.247
• Hs Code.: 2935009090
• NSC Number: 3547
• UNII: UQX4WE4HS8
• DSSTox Substance ID: DTXSID10968046
• Nikkaji Number: J41.372K
• Wikidata: Q82950732
• Mol file: 5339-67-3.mol

Synonyms:N-Ethylbenzenesulfonamide;5339-67-3;Benzenesulfonamide, N-ethyl-;N-ETHYLBENZSULFAMIDE;AI3-01082;NSC 3547;n-ethyl benzenesulfonamide;BRN 2096148;NSC-3547;3-11-00-00052 (Beilstein Handbook Reference);NSC3547;n-ethyl-benzenesulfonamide;UQX4WE4HS8;WLN: WSR&M2;SCHEMBL301743;DTXSID10968046;MFCD01211965;AKOS003837237;AS-82904;LS-31579;CS-0453343;E77690;EN300-1453225

Chemical Property of N-Ethylbenzenesulfonamide

Chemical Property:

• Vapor Pressure: 0.00131mmHg at 25°C
• Boiling Point: 297.9°Cat760mmHg
• Flash Point: 134°C
• PSA: 54.55000
• Density: 1.183g/cm³
• LogP: 2.45650
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 185.05104977
• Heavy Atom Count: 12
• Complexity: 212

Purity/Quality:

99%, ^*data from raw suppliers

N-ETHYLBENZSULFAMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Moderately toxic by ingestion.
• Hazard Codes: Moderately toxic by ingestion.

MSDS Files:

Useful:

• Canonical SMILES: CCNS(=O)(=O)C1=CC=CC=C1
• Uses: Agricultural chemical.

Technology Process of N-Ethylbenzenesulfonamide

There total 10 articles about 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%

→ N-ethylbenzenesulfonamide (5339-67-3)

Guidance literature:

In methanol; at 20 ℃; for 2h;

Reference yield: 87.0%

N-Benzyl-N-ethyl-benzenesulfonamide (74805-37-1) → N-ethylbenzenesulfonamide (5339-67-3)

Guidance literature:

With Oxone; potassium bromide; In nitromethane; at 30 ℃; for 24h; Green chemistry;

DOI:10.1021/ol501703y

Reference yield: 85.0%

N-(phenylsulfonyl)acetamide (5661-14-3) → N-ethylbenzenesulfonamide (5339-67-3)

Guidance literature:

With dimethylsulfide borane complex; In tetrahydrofuran; Ambient temperature;

upstream raw materials:

ethylamine

benzenesulfonyl chloride

benzenesulfonamide

ethyl cyanate

Downstream raw materials:

N-ethyl-N-nitro-benzenesulfonamide

ethylpropylamine

Et-N(SO₂Ph)2

N-(2-Chloro-benzoyl)-N-ethyl-benzenesulfonamide

Refernces

• 1、 Hosseini, Raziyeh,Mohammadiannejad, Kazem,Ranjbar-Karimi, Reza. "Synthesis of N-substituted sulfonamides containing perhalopyridine moiety as bio-active candidates". . . Retrieved 2020/03/18.
• 2、 Izzo, Flavia,Sch?fer, Martina,Stockman, Robert,Lücking, Ulrich. "A New, Practical One-Pot Synthesis of Unprotected Sulfonimidamides by Transfer of Electrophilic NH to Sulfinamides". supporting information. p. 15189 - 15193. Retrieved 2017/10/12.