1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene

Base Information

Chemical Name:1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene
CAS No.:40230-93-1
Molecular Formula:C12H13 F3 Si
Molecular Weight:242.316
Hs Code.:2931900090
DSSTox Substance ID:DTXSID40401537
Nikkaji Number:J559.019A
Wikidata:Q82204697
Mol file:40230-93-1.mol

Synonyms:40230-93-1;1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene;Trimethyl-[2-[3-(trifluoromethyl)phenyl]ethynyl]silane;trimethyl((3-(trifluoromethyl)phenyl)ethynyl)silane;SCHEMBL1477351;DTXSID40401537;AKOS015889146;Trimethyl-(3-trifluoromethylphenylethynyl)-silane;1-((TRIMETHYLSILYL)ETHYNYL)-3-TRIFLUORO&;1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene, 98%

Suppliers and Price of 1-[(Trimethylsilyl)ethynyl]-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

Sigma-Aldrich
1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene 98%
5ml
$ 62.30

American Custom Chemicals Corporation
1-[(TRIMETHYLSILYL)ETHYNYL]-3-(TRIFLUOROMETHYL)BENZENE 95.00%
25ML
$ 1246.25

American Custom Chemicals Corporation
1-[(TRIMETHYLSILYL)ETHYNYL]-3-(TRIFLUOROMETHYL)BENZENE 95.00%
5ML
$ 810.81

Total 10 raw suppliers

Chemical Property of 1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene

Chemical Property:

Vapor Pressure:0.144mmHg at 25°C
Refractive Index:n20/D 1.4760(lit.)
Boiling Point:50-52 °C0.5 mm Hg(lit.)
Flash Point:185 °F
PSA：0.00000
Density:1.036 g/mL at 25 °C(lit.)
LogP:3.93430
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:242.07386144
Heavy Atom Count:16
Complexity:300

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene 98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C[Si](C)(C)C#CC1=CC(=CC=C1)C(F)(F)F

Technology Process of 1-[(Trimethylsilyl)ethynyl]-3-(trifluoromethyl)benzene

There total 3 articles about 1-[(Trimethylsilyl)ethynyl]-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: 100.0%

: 401-78-5
3-bromo-1-trifluoromethylbenzene

: 1066-54-2
trimethylsilylacetylene

: 40230-93-1
3-<(trimethylsilyl)ethynyl>benzotrifluoride

Guidance literature:: With triethylamine; bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; In ethyl acetate; at 50 ℃; for 18h;

Reference yield: 99.0%

: 401-81-0
m-trifluoromethylphenyl iodide

: 1066-54-2
trimethylsilylacetylene

: 40230-93-1
3-<(trimethylsilyl)ethynyl>benzotrifluoride

Guidance literature:: With copper(l) iodide; triethylamine; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; at 20 ℃;
DOI:10.1016/S0040-4039(02)01538-1