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

Base Information

Chemical Name:4-Methyl-2-nitro-1-(trifluoromethyl)benzene
CAS No.:154057-13-3
Molecular Formula:C8H6F3NO2
Molecular Weight:205.136
Hs Code.:2904909090
DSSTox Substance ID:DTXSID50599878
Wikidata:Q82495841
Mol file:154057-13-3.mol

Synonyms:4-methyl-2-nitro-1-(trifluoromethyl)benzene;154057-13-3;4-Methyl-2-nitrobenzotrifluoride;3-Nitro-4-(trifluoromethyl)toluene;MFCD16140172;3-NITRO-4-TRIFLUOROMETHYLTOLUENE;SCHEMBL8002173;2-Nitro-4-methylbenzotrifluoride;DTXSID50599878;CL8834;AKOS005258090;DS-1178;SY110707;DB-358395;AM20050392;CS-0112320;EN300-267276;A883759;5-methyl-2-(trifluoromethyl)nitrobenzene, 4-methyl-2-nitro-1-(trifluoromethyl)benzene

Suppliers and Price of 4-Methyl-2-nitro-1-(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

TRC
4-Methyl-2-nitro-1-(trifluoromethyl)benzene
250mg
$ 75.00

TRC
4-Methyl-2-nitro-1-(trifluoromethyl)benzene
1g
$ 170.00

Medical Isotopes, Inc.
4-Methyl-2-nitro-1-(trifluoromethyl)benzene 95+%
1 g
$ 364.00

Matrix Scientific
4-Methyl-2-nitrobenzotrifluoride 95%
1g
$ 208.00

Crysdot
4-Methyl-2-nitro-1-(trifluoromethyl)benzene 97%
25g
$ 891.00

Crysdot
4-Methyl-2-nitro-1-(trifluoromethyl)benzene 97%
10g
$ 426.00

Crysdot
4-Methyl-2-nitro-1-(trifluoromethyl)benzene 97%
5g
$ 256.00

Chemenu
4-Methyl-2-nitrobenzotrifluoride 95+%
5g
$ 241.00

Apolloscientific
3-Nitro-4-(trifluoromethyl)toluene 95%
5g
$ 155.00

Apolloscientific
3-Nitro-4-(trifluoromethyl)toluene 95%
1g
$ 49.00

Total 24 raw suppliers

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

Chemical Property:

Boiling Point:238.9±40.0 °C(Predicted)
PSA：45.82000
Density:1.357±0.06 g/cm3(Predicted)
LogP:3.44520
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:0
Exact Mass:205.03506292
Heavy Atom Count:14
Complexity:224

Purity/Quality:

97% ^*data from raw suppliers

4-Methyl-2-nitro-1-(trifluoromethyl)benzene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=C(C=C1)C(F)(F)F)[N+](=O)[O-]

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

There total 2 articles about 4-Methyl-2-nitro-1-(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: 77.0%

: 27329-27-7
4-methyl-2-nitrobenzoic acid

: 154057-13-3
4-methyl-2-nitro-1-(trifluoromethyl)benzene

Guidance literature:: With sulfur tetrafluoride; hydrogen fluoride; at 85 ℃; for 24h; Autoclave; Inert atmosphere;
DOI:10.1021/acs.joc.9b03011

Reference yield: 35.14%

: 1514-87-0
metyhyl chlorodifluoroacetate

: 5326-34-1
4-Bromo-3-nitrotoluene

: 154057-13-3
4-methyl-2-nitro-1-(trifluoromethyl)benzene

Guidance literature:: metyhyl chlorodifluoroacetate; 4-Bromo-3-nitrotoluene; With potassium fluoride; In N,N-dimethyl-formamide; for 0.166667h; Inert atmosphere;

With copper(l) iodide; In N,N-dimethyl-formamide; at 110 ℃; for 48h; Inert atmosphere;