2-PHENYLBENZOYL METHIDE

The Ethanone,1-[1,1'-biphenyl]-2-yl-, with the CAS registry number 2142-66-7, is also known as o-Phenylacetophenone. Its EINECS number is 249-962-5. This chemical's molecular formula is C₁₄H₁₂O and molecular weight is 196.24. What's more, its systematic name is 1-biphenyl-2-ylethanone.

Physical properties of Ethanone,1-[1,1'-biphenyl]-2-yl- are: (1)ACD/LogP: 2.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.87; (4)ACD/LogD (pH 7.4): 2.87; (5)ACD/BCF (pH 5.5): 89.74; (6)ACD/BCF (pH 7.4): 89.74; (7)ACD/KOC (pH 5.5): 870.07; (8)ACD/KOC (pH 7.4): 870.07; (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: 1.567; (14)Molar Refractivity: 60.87 cm³; (15)Molar Volume: 186.2 cm³; (16)Polarizability: 24.13×10^-24cm³; (17)Surface Tension: 39.1 dyne/cm; (18)Density: 1.053 g/cm³; (19)Flash Point: 146.1 °C; (20)Enthalpy of Vaporization: 58.07 kJ/mol; (21)Boiling Point: 337.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000105 mmHg at 25°C.

Preparation: this chemical can be prepared by acetic acid anhydride and Biphenyl-2-ylmagnesiumjodid at the temperature of 5 - 10 °C. This reaction will need solvent diethyl ether with the reaction time of 0.5 hour. The yield is about 64%.

Uses of Ethanone,1-[1,1'-biphenyl]-2-yl-: it can be used to produce 2-biphenylylacetothiomorpholide by heating. It will need reagent sulfur with the reaction time of 3 hours. The yield is about 88%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2ccccc2c1ccccc1)C
(2)InChI: InChI=1S/C14H12O/c1-11(15)13-9-5-6-10-14(13)12-7-3-2-4-8-12/h2-10H,1H3
(3)InChIKey: XZWYAMYRMMMHKM-UHFFFAOYSA-N