1-(2,6-Dimethylphenyl)-2,2,2-trifluoroethanone

Base Information

• Chemical Name: 1-(2,6-Dimethylphenyl)-2,2,2-trifluoroethanone
• CAS No.: 121456-63-1
• Molecular Formula: C10H9 F3 O
• Molecular Weight: 202.1730696
• DSSTox Substance ID: DTXSID70595493
• Wikidata: Q82490503
• Mol file: 121456-63-1.mol

Synonyms:1-(2,6-DIMETHYLPHENYL)-2,2,2-TRIFLUOROETHANONE;121456-63-1;2',6'-Dimethyl-2,2,2-trifluoroacetophenone;Ethanone, 1-(2,6-dimethylphenyl)-2,2,2-trifluoro- (9CI);1-(2,6-DIMETHYLPHENYL)-2,2,2-TRIFLUOROETHAN-1-ONE;MFCD01319986;1-(2,6-Dimethyl-phenyl)-2,2,2-trifluoro-ethanone;SCHEMBL7246750;DTXSID70595493;AKOS005259454;AB08928;DB-353837;CS-0279447;EN300-1938637;2,2,2-trifluoro-1-(2,6-dimethylphenyl)-ethanone;ETHANONE, 1-(2,6-DIMETHYLPHENYL)-2,2,2-TRIFLUORO-

Chemical Property of 1-(2,6-Dimethylphenyl)-2,2,2-trifluoroethanone

Chemical Property:

• Vapor Pressure: 0.191mmHg at 25°C
• Refractive Index: 1.458
• Boiling Point: 210.6°Cat760mmHg
• Flash Point: 94.2°C
• PSA: 17.07000
• Density: 1.189g/cm³
• LogP: 3.04840
• Storage Temp.: 2-8°C
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 202.06054939
• Heavy Atom Count: 14
• Complexity: 212

Purity/Quality:

98%min ^*data from raw suppliers

1-(2,6-Dimethylphenyl)-2,2,2-trifluoroethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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