3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile

Base Information

Chemical Name:3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile
CAS No.:32083-31-1
Molecular Formula:C₉H₇ClN₂O₂S
Molecular Weight:242.686
Hs Code.:2926909090
DSSTox Substance ID:DTXSID90353092
Mol file:32083-31-1.mol

Synonyms:3-amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile;AC1LEIRF;Maybridge1_004631;DTXSID90353092;FT-0614926

Suppliers and Price of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile

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

American Custom Chemicals Corporation
3-AMINO-2-[(4-CHLOROPHENYL)SULFONYL]ACRYLONITRILE 95.00%
1G
$ 886.53

Total 5 raw suppliers

Chemical Property of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile

Chemical Property:

Vapor Pressure:1.14E-10mmHg at 25°C
Melting Point:213 °C
Refractive Index:1.606
Boiling Point:513.8°Cat760mmHg
PKA:-1.34±0.70(Predicted)
Flash Point:264.6°C
PSA：92.33000
Density:1.456g/cm³
LogP:3.21848
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:241.9916763
Heavy Atom Count:15
Complexity:394

Purity/Quality:

99% ^*data from raw suppliers

3-AMINO-2-[(4-CHLOROPHENYL)SULFONYL]ACRYLONITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s): R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
Hazard Codes: Xn:Harmful;
Statements: R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
Safety Statements: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39:Wear suitabl

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1S(=O)(=O)C(=CN)C#N)Cl

Technology Process of 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile

There total 4 articles about 3-Amino-2-(4-chlorophenyl)sulfonylprop-2-enenitrile 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: 87.0%

: 1851-09-8
2-(4-chlorobenzenesulfonyl)acetonitrile

: 15500-60-4
N,N-bis(trimethylsilyl)formamide

: 32083-31-1
(E)-3-Amino-2-(4-chloro-benzenesulfonyl)-acrylonitrile

Guidance literature:: at 100 ℃; for 0.0666667h;

Reference yield:

: 32083-27-5
2-(4-chloro-benzenesulfonyl)-3-ethoxy-acrylonitrile

: 32083-31-1
(E)-3-Amino-2-(4-chloro-benzenesulfonyl)-acrylonitrile

Guidance literature:: With ammonia; In ethanol;

Reference yield:

: 1851-09-8
2-(4-chlorobenzenesulfonyl)acetonitrile

: 32083-31-1
(E)-3-Amino-2-(4-chloro-benzenesulfonyl)-acrylonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: ZnCl₂, Ac₂O / 120 - 130 °C

2: NH₃ / tetrahydrofuran

With ammonia; acetic anhydride; zinc(II) chloride; In tetrahydrofuran;