4-Chloro-1-ethenyl-2-nitrobenzene

Base Information

• Chemical Name: 4-Chloro-1-ethenyl-2-nitrobenzene
• CAS No.: 146667-89-2
• Molecular Formula: C₈H₆ClNO₂
• Molecular Weight: 183.594
• DSSTox Substance ID: DTXSID801299779
• Mol file: 146667-89-2.mol

Synonyms:4-Chloro-1-ethenyl-2-nitrobenzene;146667-89-2;2-nitro-p-chlorostyrene;SCHEMBL366123;PFMOOHLTRKNGDY-UHFFFAOYSA-N;DTXSID801299779;EN300-1985997

Chemical Property of 4-Chloro-1-ethenyl-2-nitrobenzene

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 183.0087061
• Heavy Atom Count: 12
• Complexity: 190

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CC1=C(C=C(C=C1)Cl)[N+](=O)[O-]

Technology Process of 4-Chloro-1-ethenyl-2-nitrobenzene

There total 2 articles about 4-Chloro-1-ethenyl-2-nitrobenzene 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:

2-chloro-5-bromonitrobenzene (41513-04-6) + potassium vinyltrifluoroborate → 4-chloro-2-nitro-1-vinylbenzene (146667-89-2)

Guidance literature:

With caesium carbonate; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; In tetrahydrofuran; at 80 ℃;

Reference yield:

ethene (74-85-1) + 2-chloro-5-bromonitrobenzene (41513-04-6) → 4-chloro-2-nitro-1-vinylbenzene (146667-89-2)

Guidance literature:

With palladium diacetate; tris-(o-tolyl)phosphine;

Reference yield: 64.0%

methyl nitrite (624-91-9) + 4-chloro-2-nitro-1-vinylbenzene (146667-89-2) → 2,2-dimethoxy-1-(4-chloro-2-nitrophenyl)ethane (146667-96-1)

Guidance literature:

With oxygen; sodium tetrachloropalladate(II); In methanol; under 1 Torr; Ambient temperature;

upstream raw materials:

ethene

2-chloro-5-bromonitrobenzene

Downstream raw materials:

2,2-dimethoxy-1-(4-chloro-2-nitrophenyl)ethane

6-chloroindole

methyl 4'-ethyl-2-methyl-3'-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)biphenyl-4-carboxylate

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