Products 94856-20-9

CAS 94856-20-9 is the registry number for 1-(2,4-Dimethylphenyl)-4,4,4-trifluoro-1,3-butanedione. Offered by: TRC. Available pack sizes: 500mg.

1-(2,4-Dimethylphenyl)-4,4,4-trifluoro-1,3-butanedione
TRC
  • size: 500mg
  • Variants: 1
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Structural formula: {0} (CAS {1})

1-(2,4-dimethylphenyl)-4,4,4-trifluorobutane-1,3-dione (CAS 94856-20-9) is a chemical compound with the molecular formula C12H11F3O2 and a molecular weight of 244.21 g/mol. IUPAC name: 1-(2,4-dimethylphenyl)-4,4,4-trifluorobutane-1,3-dione. InChIKey: DSEGNKJPZXXYBD-UHFFFAOYSA-N.

Identity
Molecular formulaC12H11F3O2
Molecular weight244.21 g/mol
IUPAC name1-(2,4-dimethylphenyl)-4,4,4-trifluorobutane-1,3-dione
InChIKeyDSEGNKJPZXXYBD-UHFFFAOYSA-N
SMILESCC1=CC(=C(C=C1)C(=O)CC(=O)C(F)(F)F)C

Computed by PubChem (NCBI)

Synonyms: 1-(2,4-Dimethylphenyl)-4,4,4-trifluorobutane-1,3-dione, 1-(2,4-Dimethylphenyl)-4,4,4-trifluoro-1,3-butanedione, 1,3-Butanedione, 1-(2,4-dimethylphenyl)-4,4,4-trifluoro-, Celecoxib Impurity N2, DSEGNKJPZXXYBD-UHFFFAOYSA-N, 1-(2,4-dimethylphenyl)-4,4,4-tris(fluoranyl)butane-1,3-dione
Isomers (same molecular formula)
1-[[4-(trifluoromethyl)phenyl]methyl]cyclopropane-1-carboxylic acid C12H11F3O2
methyl 1-[4-(trifluoromethyl)phenyl]cyclopropane-1-carboxylate C12H11F3O2
1-[4-(trifluoromethyl)phenyl]cyclobutane-1-carboxylic acid C12H11F3O2
1-[3-(trifluoromethyl)phenyl]cyclobutane-1-carboxylic acid C12H11F3O2
6-(2,2,2-trifluoroethoxy)-3,4-dihydro-2H-naphthalen-1-one C12H11F3O2
2-[1-[2-(trifluoromethyl)phenyl]cyclopropyl]acetic acid C12H11F3O2
methyl 3-cyclopropyl-5-(trifluoromethyl)benzoate C12H11F3O2
1-(4-ethylphenyl)-4,4,4-trifluorobutane-1,3-dione C12H11F3O2
1-(3,4-dimethylphenyl)-4,4,4-trifluorobutane-1,3-dione C12H11F3O2
1,1,1-trifluoro-5-(4-methylphenyl)pentane-2,4-dione C12H11F3O2
7-(trifluoromethyl)-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid C12H11F3O2
3-[4-(trifluoromethyl)phenyl]cyclobutane-1-carboxylic acid C12H11F3O2