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Name |
Ethanone,2,2,2-trifluoro-1-(1-piperidinyl)- |
EINECS | 200-258-5 |
CAS No. | 340-07-8 | Density | 1.248 g/cm3 |
PSA | 20.31000 | LogP | 1.49910 |
Solubility | N/A | Melting Point |
N/A |
Formula | C7H10F3NO | Boiling Point | 247.5 °C at 760 mmHg |
Molecular Weight | 181.158 | Flash Point | 103.5 °C |
Transport Information | UN 2810 | Appearance | light yellow oil |
Safety | 45-61 | Risk Codes | 25-50 |
Molecular Structure | Hazard Symbols | T | |
Synonyms |
N-(Trifluoroacetyl)piperidine;2,2,2-Trifluoro-1-(piperidin-1-yl)ethanone;1-(Trifluoroacetyl)piperidine;Piperidine,1-(trifluoroacetyl)- (6CI,7CI,8CI,9CI); |
Article Data | 1 |
The Ethanone, 2, 2, 2-trifluoro-1-(1-piperidinyl)-, with the CAS registry number of 340-07-8, is also known as 1-Trifluoroacetyl piperidine. It belongs to the product categories of Acids and Derivatives; Heterocycles; Piperidine; API Intermediates; Miscellaneous Reagents; Building Blocks; Heterocyclic Building Blocks; Piperidines. This chemical's molecular formula is C7H10F3NO and molecular weight is 181.1556096. What's more, its IUPAC name is 2, 2, 2-Trifluoro-1-piperidin-1-ylethanone.
Physical properties about Ethanone, 2, 2, 2-trifluoro-1-(1-piperidinyl)- are: (1)ACD/LogP: 2.25; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.25; (4)ACD/LogD (pH 7.4): 2.25; (5)ACD/BCF (pH 5.5): 30.4; (6)ACD/BCF (pH 7.4): 30.4; (7)ACD/KOC (pH 5.5): 400.89; (8)ACD/KOC (pH 7.4): 400.89; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.414; (14)Molar Refractivity: 36.28 cm3; (15)Molar Volume: 145.1 cm3; (16)Surface Tension: 28.6 dyne/cm; (17)Density: 1.248 g/cm3; (18)Flash Point: 103.5 °C; (19)Enthalpy of Vaporization: 48.47 kJ/mol; (20)Boiling Point: 247.5 °C at 760 mmHg; (21)Vapour Pressure: 0.0256 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
This chemical is toxic if swallowed. In addition, it is very toxic to aquatic organisms. During using it, you should avoid releasing it to the environment. And refer to special instructions/safety data sheet.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N1CCCCC1)C(F)(F)F
(2) InChI: InChI=1/C7H10F3NO/c8-7(9,10)6(12)11-4-2-1-3-5-11/h1-5H2
(3) InChIKey: BCJUMGSHTLYECD-UHFFFAOYAX