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Name |
Ethanone, 2-phenyl-1-[4-(trifluoromethyl)phenyl]- |
EINECS | N/A |
CAS No. | 61062-55-3 | Density | 1.228g/cm3 |
PSA | 17.07000 | LogP | 4.13080 |
Solubility | N/A | Melting Point |
N/A |
Formula | C15H11F3O | Boiling Point | 343.4 °C at 760 mmHg |
Molecular Weight | 264.247 | Flash Point | 175.4 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-36/37/39 | Risk Codes | 36/37/38 |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
NSC254072; |
Article Data | 23 |
The Ethanone, 2-phenyl-1-[4-(trifluoromethyl)phenyl]-, with CAS registry number 61062-55-3, has the systematic name of 2-phenyl-1-[4-(trifluoromethyl)phenyl]ethanone. Besides this, it is also called 2-Phenyl-4'-trifluoromethylacetophenone. And the chemical formula of this chemical is C15H11F3O.
Physical properties of Ethanone, 2-phenyl-1-[4-(trifluoromethyl)phenyl]-: (1)ACD/LogP: 4.15; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 17.07 Å2; (7)Index of Refraction: 1.523; (8)Molar Refractivity: 65.74 cm3; (9)Molar Volume: 215.1 cm3; (10)Polarizability: 26.06×10-24cm3; (11)Surface Tension: 34.5 dyne/cm; (12)Density: 1.228 g/cm3; (13)Flash Point: 175.4 °C; (14)Enthalpy of Vaporization: 58.73 kJ/mol; (15)Boiling Point: 343.4 °C at 760 mmHg; (16)Vapour Pressure: 7.04E-05 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Ethanone, 2-phenyl-1-[4-(trifluoromethyl)phenyl]- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: FC(F)(F)c2ccc(C(=O)Cc1ccccc1)cc2
(2)InChI: InChI=1/C15H11F3O/c16-15(17,18)13-8-6-12(7-9-13)14(19)10-11-4-2-1-3-5-11/h1-9H,10H2
(3)InChIKey: SOHDNUBGOFCYMP-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C15H11F3O/c16-15(17,18)13-8-6-12(7-9-13)14(19)10-11-4-2-1-3-5-11/h1-9H,10H2
(5)Std. InChIKey: SOHDNUBGOFCYMP-UHFFFAOYSA-N