1-Ethynyl-3-(trifluoromethyl)benzene

Base Information

Chemical Name:1-Ethynyl-3-(trifluoromethyl)benzene
CAS No.:705-28-2
Molecular Formula:C9H5F3
Molecular Weight:170.134
Hs Code.:2903999090
European Community (EC) Number:628-245-4
DSSTox Substance ID:DTXSID80380973
Nikkaji Number:J976.158F
Wikidata:Q72512273
Mol file:705-28-2.mol

Synonyms:705-28-2;1-ethynyl-3-(trifluoromethyl)benzene;3-(Trifluoromethyl)phenylacetylene;3-Ethynyl-alpha,alpha,alpha-trifluorotoluene;1-Ethynyl-3-(trifluoromethyl)-Benzene;Benzene, 1-ethynyl-3-(trifluoromethyl)-;MFCD00467355;3-Ethynylbenzotrifluoride;SCHEMBL933875;3-trifluoromethylphenylacetylene;3-trifluoromethylphenyl acetylene;DTXSID80380973;[3-(Trifluoromethyl)phenyl]ethyne;1-Ethynyl-3-trifluoromethylbenzene;3-(trifluoromethyl)-phenylacetylene;AKOS005257066;AB91829;PS-8709;CS-0077611;FT-0694624;A19086;A50662;EN300-213780;3-Ethynyl-alpha,alpha,alpha-trifluorotoluene, 97%;3-Ethynyl- alpha , alpha , alpha -trifluorotoluene;Toluene, m-ethenyl-.alpha.,.alpha.,.alpha.-trifluoro-

Suppliers and Price of 1-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

TRC
3-(Trifluoromethyl)phenylacetylene
50mg
$ 45.00

SynQuest Laboratories
3-(Trifluoromethyl)phenylacetylene 98%
25 g
$ 592.00

SynQuest Laboratories
3-(Trifluoromethyl)phenylacetylene 98%
5 g
$ 151.00

SynQuest Laboratories
3-(Trifluoromethyl)phenylacetylene 98%
1 g
$ 58.00

Sigma-Aldrich
3-Ethynyl-α,α,α-trifluorotoluene 97%
5g
$ 208.00

Apolloscientific
3-(Trifluoromethyl)phenylacetylene 98%
25g
$ 370.00

Apolloscientific
3-(Trifluoromethyl)phenylacetylene 98%
5g
$ 94.00

Apolloscientific
3-(Trifluoromethyl)phenylacetylene 98%
1g
$ 36.00

American Custom Chemicals Corporation
3-(TRIFLUOROMETHYL)PHENYL ACETYLENE 95.00%
1G
$ 629.90

American Custom Chemicals Corporation
3-(TRIFLUOROMETHYL)PHENYL ACETYLENE 95.00%
5G
$ 890.46

Total 30 raw suppliers

Chemical Property of 1-Ethynyl-3-(trifluoromethyl)benzene

Chemical Property:

Vapor Pressure:2.76mmHg at 25°C
Refractive Index:n20/D 1.464(lit.)
Boiling Point:162.9 °C at 760 mmHg
Flash Point:44.6 °C
PSA：0.00000
Density:1.21 g/cm³
LogP:2.68670
XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:170.03433465
Heavy Atom Count:12
Complexity:196

Purity/Quality:

97% ^*data from raw suppliers

3-(Trifluoromethyl)phenylacetylene ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 10-20/21/22
Safety Statements: 16-26-36-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:C#CC1=CC(=CC=C1)C(F)(F)F
Uses 3-(TRIFLUOROMETHYL)PHENYLACETYLENE is a useful research chemical. 3-Ethynyl-α,α,α-trifluorotoluene may be used to synthesize:1-thioacetyl-4[3-trifluoromethyl-1-(ethynyl)phenyl]benzene4-{[4-(3-(trifluoromethyl)phenyl)-1H-1,2,3-triazol-1-yl]methyl}benzoic acid4-{4-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazol-1-yl}benzoic acid

Technology Process of 1-Ethynyl-3-(trifluoromethyl)benzene

There total 24 articles about 1-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: 80.0%