4-CHLORO-4'-METHYLBENZOPHENONE

The CAS registry number of Methanone,(4-chlorophenyl)(4-methylphenyl)- is 5395-79-9. The IUPAC name is (4-chlorophenyl)-(4-methylphenyl)methanone. In addition, the molecular formula is C₁₄H₁₁ClO and the molecular weight is 230.69. It belongs to the class of Drug/Therapeutic Agent and should be stored in a cool and dry place.

Physical properties about this chemical are: (1)ACD/LogP: 4.36; (2)ACD/LogD (pH 5.5): 4.36; (3)ACD/LogD (pH 7.4): 4.36; (4)ACD/BCF (pH 5.5): 1216.03; (5)ACD/BCF (pH 7.4): 1216.03; (6)ACD/KOC (pH 5.5): 5620.85; (7)ACD/KOC (pH 7.4): 5620.85; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 17.07 Å²; (11)Index of Refraction: 1.586; (12)Molar Refractivity: 65.76 cm³; (13)Molar Volume: 195.7 cm³; (14)Polarizability: 26.07 ×10^-24cm³; (15)Surface Tension: 42.6 dyne/cm; (16)Density: 1.178 g/cm³; (17)Flash Point: 197.3 °C; (18)Enthalpy of Vaporization: 61.07 kJ/mol; (19)Boiling Point: 364.5 °C at 760 mmHg; (20)Vapour Pressure: 1.68E-05 mmHg at 25°C.

Preparation of Methanone,(4-chlorophenyl)(4-methylphenyl)-: it can be prepared by 4-chloro-benzoyl chloride and methylbenzene. This reaction will need reagent AlCl₃ and solvent chlorobenzene.

Uses of Methanone,(4-chlorophenyl)(4-methylphenyl)-: it can be used to get 4-(4-chlorobenzoyl)benzyl bromide. This reaction will need reagents dibenzoyl peroxide and NBS, and solvent CCl₄. The reaction time is 2 hours by heating. The yield is about 62.9%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(Cl)cc1)c2ccc(cc2)C
(2)InChI: InChI=1/C14H11ClO/c1-10-2-4-11(5-3-10)14(16)12-6-8-13(15)9-7-12/h2-9H,1H3
(3)InChIKey: MRIBPIAKCVDXLY-UHFFFAOYAI

The toxicity data is as follows: