4-(Trifluoromethyl)aniline

Base Information

Chemical Name:4-(Trifluoromethyl)aniline
CAS No.:455-14-1
Molecular Formula:C7H6F3N
Molecular Weight:161.127
Hs Code.:29214300
European Community (EC) Number:207-236-5
NSC Number:10337
UNII:RQJ623MB8G
DSSTox Substance ID:DTXSID5060013
Nikkaji Number:J59.714G
Wikidata:Q27120406
Metabolomics Workbench ID:56392
ChEMBL ID:CHEMBL1162294
Mol file:455-14-1.mol

Synonyms:4-trifluoromethylaniline;para-trifluoromethylaniline

Suppliers and Price of 4-(Trifluoromethyl)aniline

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

Usbiological
4-Aminobenzotrifluoride
100g
$ 305.00

TRC
4-(Trifluoromethyl)aniline
1g
$ 55.00

TRC
4-(Trifluoromethyl)aniline
50g
$ 215.00

TCI Chemical
4-Aminobenzotrifluoride >98.0%(GC)(T)
100mL
$ 137.00

TCI Chemical
4-Aminobenzotrifluoride >98.0%(GC)(T)
25mL
$ 40.00

SynQuest Laboratories
4-Aminobenzotrifluoride 98%
25 g
$ 25.00

SynQuest Laboratories
4-Aminobenzotrifluoride 98%
100 g
$ 35.00

SynQuest Laboratories
4-Aminobenzotrifluoride 98%
250 g
$ 65.00

SynQuest Laboratories
4-Aminobenzotrifluoride 98%
1 kg
$ 135.00

Sigma-Aldrich
Leflunomide Related Compound A United States Pharmacopeia (USP) Reference Standard
100mg
$ 1260.00

Total 215 raw suppliers

Chemical Property of 4-(Trifluoromethyl)aniline

Chemical Property:

Appearance/Colour:clear colorless to yellow liquid
Vapor Pressure:0.554mmHg at 25°C
Melting Point:3-8 °C
Refractive Index:n20/D 1.483(lit.)
Boiling Point:190 °C at 760 mmHg
PKA:2.45(at 25℃)
Flash Point:86.7 °C
PSA：26.02000
Density:1.286 g/cm³
LogP:2.86880
Storage Temp.:Refrigerator, Under Inert Atmosphere
Sensitive.:Air Sensitive
Water Solubility.:<0.1 g/100 mL
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:0
Exact Mass:161.04523368
Heavy Atom Count:11
Complexity:124

Purity/Quality:

99.5%min. ^*data from raw suppliers

4-Aminobenzotrifluoride ^*data from reagent suppliers

Safty Information:

Pictogram(s): T, N, Xi, Xn
Hazard Codes:T,N,Xi,Xn
Statements: 25-36-50/53-36/37/38-33-20/21/22
Safety Statements: 26-45-60-61-36/37/39-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C(F)(F)F)N
Uses 4-Substituted aniline derivatives exert special hematotoxicity on the red blood cells and induce leukocytosis. 4-(Trifluoromethyl)aniline was used in the synthesis of 4-(trialkylmethyl)anilines. It was also used as a synthetic building block.

Technology Process of 4-(Trifluoromethyl)aniline

There total 89 articles about 4-(Trifluoromethyl)aniline 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: 66.0%

: 887144-94-7
Togni's reagent II

: 62-53-3
aniline

: 455-14-1
4-trifluoromethylphenylamine

: 88-17-5
2-(trifluoromethyl)benzenamine

Guidance literature:: With potassium carbonate; In acetonitrile; at 75 ℃; for 6h; Schlenk technique; Inert atmosphere;
DOI:10.1016/j.tetlet.2019.151538

Reference yield: 54.0%

: 2314-97-8,263005-66-9
iodotrifluoromethane

: 62-53-3
aniline

: 455-14-1
4-trifluoromethylphenylamine

: 88-17-5
2-(trifluoromethyl)benzenamine

Guidance literature:: With fac-tris(2-phenylpyridinato-N,C₂')iridium(III); potassium carbonate; In 1,2-dichloro-ethane; at 20 ℃; for 24h; regioselective reaction; Inert atmosphere; Schlenk technique; Irradiation;
DOI:10.1016/j.tetlet.2017.09.010