Synonym: α,α,α-Trifluoroacetone; 1,1,1-Trifluoro-2-propanone; 3,3,3-Trifluoroacetone; Methyl trifluoromethyl ketone; Trifluoromethyl methyl ketone
CAS Number: 421-50-1
Empirical Formula (Hill Notation): C3H3F3O
Molecular Weight: 112.05
EC Number: 207-005-9
MDL Number: MFCD00000423
Linear Formula: CH3COCF3
Product Type: Chemical
| assay |
97% |
| bp |
22 °C (lit.) |
| density |
1.252 g/mL at 25 °C (lit.) |
| InChI |
1S/C3H3F3O/c1-2(7)3(4,5)6/h1H3 |
| InChI key |
FHUDAMLDXFJHJE-UHFFFAOYSA-N |
| refractive index |
n20/D 1.3 (lit.) |
| SMILES string |
CC(=O)C(F)(F)F |
| storage temp. |
2-8°C |
| vapor pressure |
13.62 psi ( 20 °C) |
| Application: |
Used in a synthesis of 2-trifluoromethyl-7-azaindoles starting with 2,6-dihalopyridines. The derived chiral imine was used to prepare enantiopure α-trifluoromethyl alanines and diamines via a Strecker reaction followed by either nitrile hydrolysis or reduction. |
| Packaging: |
5, 25, 100 g in glass bottle |
| Purity |
97% |
| bp |
22 °C (lit.) |
| Density |
1.252 g/mL at 25 °C (lit.) |
| Refractive Index |
n20/D 1.3 (lit.) |
| Storage Temp. |
2-8°C |
| UNSPSC |
12352100 |
GHS02,GHS07