1-Methyl-3-(trifluoroacetyl)-1H-indole

Base Information

Chemical Name:1-Methyl-3-(trifluoroacetyl)-1H-indole
CAS No.:318-54-7
Molecular Formula:C11H8 F3 N O
Molecular Weight:227.186
Hs Code.:2933990090
DSSTox Substance ID:DTXSID20393300
Nikkaji Number:J1.032.163H
ChEMBL ID:CHEMBL1494212
Mol file:318-54-7.mol

Synonyms:318-54-7;1-Methyl-3-(trifluoroacetyl)-1H-indole;2,2,2-trifluoro-1-(1-methylindol-3-yl)ethanone;2,2,2-Trifluoro-1-(1-methyl-1H-indol-3-yl)ethan-1-one;N-METHYL-3-TRIFLUOROACETYLINDOLE;SMR000179954;MLS000546556;SCHEMBL3005876;2,2,2-Trifluoro-1-(1-methyl-1H-indol-3-yl)ethanone;CHEMBL1494212;2,2,2-trifluoro-1-(1-methyl-1H-indol-3-yl)-1-ethanone;DTXSID20393300;HMS2306K13;1-Methylindole, 3-trifluoroacetyl-;MFCD02571216;AKOS015993205;AT14963;EN300-1931379;2,2,2-trifluoro-1-(1-methyl-3-indolyl)ethanone;6R-1066;A821031;2,2,2-tris(fluoranyl)-1-(1-methylindol-3-yl)ethanone

Suppliers and Price of 1-Methyl-3-(trifluoroacetyl)-1H-indole

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
2,2,2-Trifluoro-1-(1-methyl-1H-indol-3-yl)-1-ethanone
500mg
$ 220.00

TRC
2,2,2-Trifluoro-1-(1-methyl-1H-indol-3-yl)-1-ethanone
100mg
$ 65.00

SynQuest Laboratories
1-Methyl-3-(trifluoroacetyl)-1H-indole
5 g
$ 322.00

Apolloscientific
1-Methyl-3-(trifluoroacetyl)-1H-indole
5g
$ 201.00

Apolloscientific
1-Methyl-3-(trifluoroacetyl)-1H-indole
1g
$ 67.00

American Custom Chemicals Corporation
1-METHYL-3-(TRIFLUOROACETYL)-1H-INDOLE 95.00%
5G
$ 1216.45

American Custom Chemicals Corporation
1-METHYL-3-(TRIFLUOROACETYL)-1H-INDOLE 95.00%
1G
$ 708.48

Total 15 raw suppliers

Chemical Property of 1-Methyl-3-(trifluoroacetyl)-1H-indole

Chemical Property:

Vapor Pressure:0.00116mmHg at 25°C
Melting Point:105 °C
Refractive Index:1.52
Boiling Point:299.8°Cat760mmHg
Flash Point:135.1°C
PSA：22.00000
Density:1.3g/cm³
LogP:2.92330
Storage Temp.:2-8°C
Sensitive.:Light Sensitive
XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:227.05579836
Heavy Atom Count:16
Complexity:289

Purity/Quality:

97% ^*data from raw suppliers

2,2,2-Trifluoro-1-(1-methyl-1H-indol-3-yl)-1-ethanone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=C(C2=CC=CC=C21)C(=O)C(F)(F)F
General Description 1-Methyl-3-(trifluoroacetyl)-1H-indole is a trifluoroacetylated indole derivative formed through the acylation of 1-methylindole under mild conditions using a (RCO)2O/Me2S/BF3 system or via condensation reactions in trifluoroacetic acid. 1-Methyl-3-(trifluoroacetyl)-1H-indole, also known as Ketone,1-methylindol-3-yl trifluoromethyl (8CI), features a reactive trifluoroacetyl group at the 3-position of the indole ring, making it useful in synthetic organic chemistry for further functionalization or as an intermediate in heterocyclic synthesis.

Technology Process of 1-Methyl-3-(trifluoroacetyl)-1H-indole

There total 21 articles about 1-Methyl-3-(trifluoroacetyl)-1H-indole 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: 86.0%

: 603-76-9
1-methylindole

: 13081-18-0
ethyl-3,3,3-trifluoropyruvate

: 318-54-7
2,2,2-trifluoro-1-(1-methyl-1H-indol-3-yl)ethan-1-one

Guidance literature:: With copper(l) chloride; In dimethyl sulfoxide; at 100 ℃; for 12h; Reagent/catalyst; Temperature; Solvent;
DOI:10.1039/c7ob01335c