2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

Base Information

Chemical Name:2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene
CAS No.:133605-28-4
Molecular Formula:C8H5BrF3NO2
Molecular Weight:284.03
Hs Code.:2904909090
DSSTox Substance ID:DTXSID50599752
Wikidata:Q82495689
Mol file:133605-28-4.mol

Synonyms:133605-28-4;2-(BROMOMETHYL)-1-NITRO-4-(TRIFLUOROMETHYL)BENZENE;Benzene, 2-(bromomethyl)-1-nitro-4-(trifluoromethyl)-;SCHEMBL9550109;DTXSID50599752;WJRRHFDQKYISTH-UHFFFAOYSA-N

Suppliers and Price of 2-(Bromomethyl)-1-nitro-4-(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
2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene 95+%
1g
$ 554.00

Chemcia Scientific
2-Bromomethyl-1-nitro-4-trifluoromethyl-benzene 95%
0.5 G
$ 345.00

American Custom Chemicals Corporation
2-(BROMOMETHYL)-1-NITRO-4-(TRIFLUOROMETHYL)BENZENE 95.00%
5MG
$ 497.49

Alichem
2-Nitro-5-(trifluoromethyl)benzylbromide
1g
$ 1549.60

Alichem
2-Nitro-5-(trifluoromethyl)benzylbromide
500mg
$ 863.90

Alichem
2-Nitro-5-(trifluoromethyl)benzylbromide
250mg
$ 504.00

Total 6 raw suppliers

Chemical Property of 2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

Chemical Property:

Vapor Pressure:0.00808mmHg at 25°C
Refractive Index:1.526
Boiling Point:276.4°C at 760 mmHg
Flash Point:121°C
PSA：45.82000
Density:1.728g/cm³
LogP:4.03170
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:282.94558
Heavy Atom Count:15
Complexity:241

Purity/Quality:

97% ^*data from raw suppliers

2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1C(F)(F)F)CBr)[N+](=O)[O-]

Technology Process of 2-(Bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

There total 3 articles about 2-(Bromomethyl)-1-nitro-4-(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: 79.0%

: 1227604-33-2
C₈H₆F₃NO₃

: 133605-28-4
2-(bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

Guidance literature:: With carbon tetrabromide; triphenylphosphine; In dichloromethane; at 20 ℃; for 16h;
DOI:10.1021/jo200530j

Reference yield: 54.0%

: 67192-42-1
2-methyl-4-trifluoromethylnitrobenzene

: 133605-28-4
2-(bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

Guidance literature:

Reference yield:

: 1176723-57-1
2-nitro-5-(trifluoromethyl)benzaldehyde

: 133605-28-4
2-(bromomethyl)-1-nitro-4-(trifluoromethyl)benzene

Guidance literature:: Multi-step reaction with 2 steps

1: sodium tetrahydroborate / tetrahydrofuran / 2 h / 0 - 20 °C

2: carbon tetrabromide; triphenylphosphine / dichloromethane / 16 h / 20 °C

With sodium tetrahydroborate; carbon tetrabromide; triphenylphosphine; In tetrahydrofuran; dichloromethane;
DOI:10.1021/jo200530j