1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene

Base Information

Chemical Name:1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene
CAS No.:62248-94-6
Molecular Formula:C₉H₆F₃NO₂
Molecular Weight:217.147
Hs Code.:
DSSTox Substance ID:DTXSID601250808
Mol file:62248-94-6.mol

Synonyms:1-(2-nitroethenyl)-3-(trifluoromethyl)benzene;3-TrifluoroMethyl-|A-nitrostyrene;DTXSID601250808;AKOS030228312;FT-0697359

Suppliers and Price of 1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene

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

Crysdot
1-(2-Nitrovinyl)-3-(trifluoromethyl)benzene 95+%
1g
$ 518.00

American Custom Chemicals Corporation
1-(3-TRIFLUOROMETHYLPHENYL)-2-NITROETHYLENE 95.00%
5MG
$ 502.10

Alichem
1-(2-Nitrovinyl)-3-(trifluoromethyl)benzene
1g
$ 447.32

Total 14 raw suppliers

Chemical Property of 1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene

Chemical Property:

Vapor Pressure:0.0154mmHg at 25°C
Melting Point:75-77 °C(lit.)
Refractive Index:1.517
Boiling Point:265 °C at 760 mmHg
Flash Point:114.1 °C
PSA：45.82000
Density:1.355 g/cm³
LogP:3.47600
Storage Temp.:2-8°C
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:217.03506292
Heavy Atom Count:15
Complexity:257

Purity/Quality:

97% ^*data from raw suppliers

1-(2-Nitrovinyl)-3-(trifluoromethyl)benzene 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 20/21/22-36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)C(F)(F)F)C=C[N+](=O)[O-]

Technology Process of 1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene

There total 1 articles about 1-(2-Nitroethenyl)-3-(trifluoromethyl)benzene 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:

: 75-52-5
nitromethane

: 454-89-7
3-Trifluoromethylbenzaldehyde

: 115665-96-8,62248-94-6
m-Trifluormethyl-β-nitrostyrol

Guidance literature:: With potassium hydroxide;

Reference yield: 99.0%

: 120-72-9
indole

: 115665-96-8,62248-94-6
m-Trifluormethyl-β-nitrostyrol

: 1329666-66-1
(R)-3-[1-(3-trifluoromethylphenyl)-2-nitroethyl]-1H-indole

Guidance literature:: m-Trifluormethyl-β-nitrostyrol; With C₄₄H₄₆N₄O₄S₂; copper(II) bis(trifluoromethanesulfonate); In α,α,α-trifluorotoluene; at 0 ℃; for 0.166667h; Inert atmosphere;

indole; In α,α,α-trifluorotoluene; at 0 ℃; optical yield given as %ee; enantioselective reaction; Inert atmosphere;
DOI:10.1021/ol201914r

Reference yield: 99.0%

: 115665-96-8,62248-94-6
m-Trifluormethyl-β-nitrostyrol

: 67-64-1
acetone

: 1257874-95-5
(S)-5-nitro-4-(3-(trifluoromethyl)phenyl)pentan-2-one

Guidance literature:: With (1R,2R)-(-)-N-diphenylthiophosphorylcyclohexane-1,2-diamine; phenol; In toluene; at 0 ℃; for 42h; optical yield given as %ee; enantioselective reaction;
DOI:10.1002/ejoc.201000945