2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide

Base Information

Chemical Name:2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide
CAS No.:62442-86-8
Molecular Formula:C15H13 Br N2 O3 S
Molecular Weight:381.24
Hs Code.:
European Community (EC) Number:636-362-7
NSC Number:328394

Synonyms:CYSSOR I;NSC-328394;NSC328394;2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide

Suppliers and Price of 2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:482.892°C at 760 mmHg
Flash Point:245.844°C
PSA：84.31000
Density:1.491g/cm³
LogP:3.77570
Storage Temp.:−20°C
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:379.98303
Heavy Atom Count:22
Complexity:663

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=NC(=O)CBr)C=CC1=NS(=O)(=O)C2=CC=CC=C2
Isomeric SMILES:CC\1=CC(=NC(=O)CBr)C=C/C1=N\S(=O)(=O)C2=CC=CC=C2

Technology Process of 2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide

There total 5 articles about 2-Methyl-N-benzenesulfonyl-N(4)-bromoacetylquinonediimide 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: 97.0%

: 86785-38-8
2'-methyl-4'-(bromoacetamido)benzenesulfonanilide

: 62442-86-8
2-methyl-N¹-(phenylsulfonyl)-N⁴-(bromoacetyl)benzoquinone diimine

Guidance literature:: With lead(IV) acetate; In chloroform; for 2h; Ambient temperature;
DOI:10.1021/jo00167a002

Reference yield:

: 86785-33-3
N-(2-methyl)-4-nitrophenylbenzenesulfonamide

: 62442-86-8
2-methyl-N¹-(phenylsulfonyl)-N⁴-(bromoacetyl)benzoquinone diimine

Guidance literature:: Multi-step reaction with 3 steps

1: 77 percent / sodium dithionite / methanol; aq. NH₃ / 1.) 30 min, 2.) refrigerator, 1 h

2: 96 percent / potassium bicarbonate / CHCl₃ / 24.5 h / Ambient temperature

3: 97 percent / lead tetraacetate / CHCl₃ / 2 h / Ambient temperature

With lead(IV) acetate; sodium dithionite; potassium hydrogencarbonate; In methanol; ammonium hydroxide; chloroform;
DOI:10.1021/jo00167a002

Reference yield:

: 86785-35-5
2'-methyl-4'-aminobenzenesulfonanilide

: 62442-86-8
2-methyl-N¹-(phenylsulfonyl)-N⁴-(bromoacetyl)benzoquinone diimine

Guidance literature:: Multi-step reaction with 2 steps

1: 96 percent / potassium bicarbonate / CHCl₃ / 24.5 h / Ambient temperature

2: 97 percent / lead tetraacetate / CHCl₃ / 2 h / Ambient temperature

With lead(IV) acetate; potassium hydrogencarbonate; In chloroform;
DOI:10.1021/jo00167a002