1-(2-Methylnaphthyl) trifluoromethyl ketone

Base Information

• Chemical Name: 1-(2-Methylnaphthyl) trifluoromethyl ketone
• CAS No.: 131831-98-6
• Molecular Formula: C₁₃H₉F₃O
• Molecular Weight: 238.209
• DSSTox Substance ID: DTXSID40564272
• Nikkaji Number: J371.084J
• Wikidata: Q82448926
• Mol file: 131831-98-6.mol

Synonyms:1-(2-METHYLNAPHTHYL) TRIFLUOROMETHYL KETONE;131831-98-6;2,2,2-TRIFLUORO-1-(2-METHYLNAPHTHALEN-1-YL)ETHANONE;MFCD01320009;2,2,2-Trifluoro-1-(2-methylnaphthalen-1-yl)ethan-1-one;DTXSID40564272;AKOS016022535;AB08974;1-(2-Methylnaphthyl)trifluoromethyl ketone;1-(2-METHYLNAPHTHYL)TRIFLUOROMETHYLKETONE;Ethanone, 2,2,2-trifluoro-1-(2-methyl-1-naphthalenyl)-

Chemical Property of 1-(2-Methylnaphthyl) trifluoromethyl ketone

Chemical Property:

• Vapor Pressure: 0.00105mmHg at 25°C
• Boiling Point: 85-100 °C(Press: 0.3 Torr)
• Density: 1.268±0.06 g/cm3(Predicted)
• XLogP3: 4.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 238.06054939
• Heavy Atom Count: 17
• Complexity: 298

Purity/Quality:

97% ^*data from raw suppliers

1-(2-methylnaphthyl)trifluoromethylketone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C2=CC=CC=C2C=C1)C(=O)C(F)(F)F

Technology Process of 1-(2-Methylnaphthyl) trifluoromethyl ketone

There total 1 articles about 1-(2-Methylnaphthyl) trifluoromethyl ketone 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:

ethyl trifluoroacetate, (383-63-1) + 1-bromo-2-methylnaphtalene (2586-62-1) → 1-(2-methylnaphthyl) trifluoromethyl ketone (131831-98-6)

Guidance literature:

With n-butyllithium; Yield given. Multistep reaction; 2) ether, -78 deg C to room temperature;

DOI:10.1021/jo00002a082

upstream raw materials:

ethyl trifluoroacetate,

1-bromo-2-methylnaphtalene

Refernces