2,2,2-Trifluoro-1-indolinylethan-1-one

Base Information

• Chemical Name: 2,2,2-Trifluoro-1-indolinylethan-1-one
• CAS No.: 90732-28-8
• Molecular Formula: C10H8 F3 N O
• Molecular Weight: 215.175
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20402926
• Nikkaji Number: J514.767K
• Wikidata: Q82206451
• Mol file: 90732-28-8.mol

Synonyms:90732-28-8;2,2,2-TRIFLUORO-1-INDOLINYLETHAN-1-ONE;2,2,2-trifluoro-1-(indolin-1-yl)ethanone;1-(2,3-dihydroindol-1-yl)-2,2,2-trifluoroethanone;1-(trifluoroacetyl)indoline;1H-Indole, 2,3-dihydro-1-(trifluoroacetyl)-;203861-10-3;1H-Indole, 2,3-dihydro-1-(trifluoroacetyl)- (9CI);Indoline, N-trifluoroacetyl-;SCHEMBL2188078;DTXSID20402926;MFCD00495769;STK897728;AKOS003868687;MS-8370;SB64750;1-(Trifluoroacetyl)-2,3-dihydro-1H-indole;CS-0003911;1-(2,3-Dihydro-indol-1-yl)-2,2,2-trifluoro-ethanone;1-(2,3-dihydro-1H-indol-1-yl)-2,2,2-trifluoroethanone;1-(2,3-dihydro-1H-indol-1-yl)-2,2,2-trifluoroethan-1-one

Chemical Property of 2,2,2-Trifluoro-1-indolinylethan-1-one

Chemical Property:

• PSA: 20.31000
• LogP: 2.20300
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 215.05579836
• Heavy Atom Count: 15
• Complexity: 264

Purity/Quality:

99% ^*data from raw suppliers

1H-indole,2,3-dihydro-1-(trifluoroacetyl)- ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(C2=CC=CC=C21)C(=O)C(F)(F)F

Technology Process of 2,2,2-Trifluoro-1-indolinylethan-1-one

There total 12 articles about 2,2,2-Trifluoro-1-indolinylethan-1-one 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%

1-indoline (496-15-1) + trifluoroacetic anhydride (407-25-0) → 2,2,2-trifluoro-1-(indolin-1-yl)ethan-1-one (90732-28-8)

Guidance literature:

With triethylamine; In dichloromethane;

DOI:10.1016/j.bmcl.2003.11.007

Reference yield: 100.0%

2-[2-(1-chloro-2,2,2-trifluoroethylidenamino)phenyl]ethanol → 2,2,2-trifluoro-1-(indolin-1-yl)ethan-1-one (90732-28-8)

Guidance literature:

With triethylamine; In dichloromethane; at 20 ℃;

DOI:10.1021/jo701566v

Reference yield: 97.0%

2-aminophenethyl alcohol (5339-85-5) + trifluoroacetic acid (76-05-1) → 2,2,2-trifluoro-1-(indolin-1-yl)ethan-1-one (90732-28-8)

Guidance literature:

With tetrachloromethane; triethylamine; triphenylphosphine; Heating;

DOI:10.1021/jo701566v

upstream raw materials:

1-indoline

trifluoroacetic anhydride

2-aminophenethyl alcohol

trifluoroacetic acid

Downstream raw materials:

1-(2,2,2-trifluoroacetyl)indolin-5-ylsulfonyl chloride

(S)-(+)-4-phenyl-1-(indoline-5-sulfonyl)-4,5-dihydro-2-imidazolone

1-(2,3-dihydro-1H-indole-5-sulfonyl)-4-(4-fluoro-phenyl)-imidazolidin-2-one