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208173-18-6

Basic Information
CAS No.: 208173-18-6
Name: Methanone, [2-fluoro-6-(trifluoromethyl)phenyl]phenyl-
Molecular Structure:
Molecular Structure of 208173-18-6 (Methanone, [2-fluoro-6-(trifluoromethyl)phenyl]phenyl-)
Formula: C14H8F4O
Molecular Weight: 268.21
Synonyms: 2-FLUORO-6-(TRIFLUOROMETHYL)BENZOPHENONE;[2-Fluoro-6-(trifluoromethyl)phenyl](phenyl)methanone;2-Fluoro-6-(trifluoromethyl)benzophenone97%;2-FLUORO-6-(TRIFLUOROMETHYL)BENZOPHENONE 97%
EINECS: N/A
Density: 1.306 g/cm3
Melting Point: N/A
Boiling Point: 355.2 °C at 760 mmHg
Flash Point: 136 °C
Solubility: N/A
Appearance: N/A
Hazard Symbols: IrritantXi
Risk Codes: R36/38
Safety:
Transport Information: N/A
PSA: 17.07000
LogP: 4.07550
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Specification

The Methanone, [2-fluoro-6-(trifluoromethyl)phenyl]phenyl-, with CAS registry number 208173-18-6, has the systematic name of [2-fluoro-6-(trifluoromethyl)phenyl](phenyl)methanone. Besides this, it is also called 2-Fluoro-6-(trifluoromethyl)benzophenone. And the chemical formula of this chemical is C14H8F4O.

Physical properties of Methanone, [2-fluoro-6-(trifluoromethyl)phenyl]phenyl-: (1)ACD/LogP: 3.62; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.62; (4)ACD/LogD (pH 7.4): 3.62; (5)ACD/BCF (pH 5.5): 333.33; (6)ACD/BCF (pH 7.4): 333.33; (7)ACD/KOC (pH 5.5): 2225.75; (8)ACD/KOC (pH 7.4): 2225.75; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.506; (14)Molar Refractivity: 61.01 cm3; (15)Molar Volume: 205.2 cm3; (16)Polarizability: 24.19×10-24cm3; (17)Surface Tension: 32.8 dyne/cm; (18)Density: 1.306 g/cm3; (19)Flash Point: 136 °C; (20)Enthalpy of Vaporization: 60.04 kJ/mol; (21)Boiling Point: 355.2 °C at 760 mmHg; (22)Vapour Pressure: 3.17E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1c(cccc1F)C(F)(F)F)c2ccccc2
(2)InChI: InChI=1/C14H8F4O/c15-11-8-4-7-10(14(16,17)18)12(11)13(19)9-5-2-1-3-6-9/h1-8H
(3)InChIKey: GZERPYCCZRGZNF-UHFFFAOYAH
(4)Std. InChI: InChI=1S/C14H8F4O/c15-11-8-4-7-10(14(16,17)18)12(11)13(19)9-5-2-1-3-6-9/h1-8H
(5)Std. InChIKey: GZERPYCCZRGZNF-UHFFFAOYSA-N