N-(2-Nitrophenyl)benzenesulfonamide

Base Information

• Chemical Name: N-(2-Nitrophenyl)benzenesulfonamide
• CAS No.: 6933-51-3
• Molecular Formula: C12H10N2O4S
• Molecular Weight: 278.288
• NSC Number: 142099
• DSSTox Substance ID: DTXSID50301256
• Nikkaji Number: J1.127.754C
• Wikidata: Q82044964
• ChEMBL ID: CHEMBL448843
• Mol file: 6933-51-3.mol

Synonyms:N-(2-Nitrophenyl)benzenesulfonamide;6933-51-3;2'-Nitrobenzenesulfonanilide;MLS002920542;NSC142099;CHEMBL448843;SCHEMBL2003165;DTXSID50301256;QYEQJQLZLZRQEB-UHFFFAOYSA-N;MFCD00193728;STK090834;AKOS000493657;N-(2-Nitrophenyl)benzenesulfonamide #;NSC-142099;SB81790;LS-07447;SMR001798131;EU-0036325

Chemical Property of N-(2-Nitrophenyl)benzenesulfonamide

Chemical Property:

• Vapor Pressure: 2.45E-08mmHg at 25°C
• Boiling Point: 451.3°Cat760mmHg
• Flash Point: 226.8°C
• PSA: 100.37000
• Density: 1.461g/cm³
• LogP: 4.07260
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 278.03612798
• Heavy Atom Count: 19
• Complexity: 406

Purity/Quality:

95% ^*data from raw suppliers

N-(2-Nitrophenyl)benzenesulfonamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2[N+](=O)[O-]

Technology Process of N-(2-Nitrophenyl)benzenesulfonamide

There total 10 articles about N-(2-Nitrophenyl)benzenesulfonamide 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: 91.0%

benzenesulfonamide (98-10-2) + 2-nitrophenyl bromide (577-19-5) → N-(2-nitrophenyl)benzenesulfonamide (6933-51-3)

Guidance literature:

With tetrabutylammonium acetate; palladium diacetate; at 35 ℃; for 4h; Green chemistry;

DOI:10.1080/17415993.2015.1122010

Reference yield: 71.0%

2-nitro-aniline (88-74-4) + benzenesulfonyl chloride (98-09-9) → N-(2-nitrophenyl)benzenesulfonamide (6933-51-3)

Guidance literature:

With dmap; In pyridine; for 18h; Heating;

Reference yield: 69.0%

benzenesulfonamide (98-10-2) + ortho-nitrofluorobenzene (1493-27-2,127723-77-7) → N-(2-nitrophenyl)benzenesulfonamide (6933-51-3)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide; at 20 - 50 ℃;

DOI:10.1080/00304940409356635

upstream raw materials:

2-nitro-aniline

benzenesulfonyl chloride

N-phenylbenzenesulfonamide

benzenesulfonamide

Downstream raw materials:

N-(2-amino-4-chlorophenyl)benzenesulfonamide

benzenesulfonic acid-[N-(2-hydroxy-ethyl)-2-nitro-anilide]

N-(2-Nitrophenyl)-N-(2-prop-2-enylcyclohex-2-enyl)benzenesulfonamide

methyl 4-[({5-chloro-2-[(phenylsulfonyl)amino]phenyl}amino)carbonyl]benzoate

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