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4'-Chloro-4-trifluoromethoxybenzophenone

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Name

4'-Chloro-4-trifluoromethoxybenzophenone

EINECS 289-367-8
CAS No. 87996-55-2 Density 1.367 g/cm3
Solubility Melting Point
Formula C14H8ClF3O2 Boiling Point 344.7 °C at 760 mmHg
Molecular Weight 300.66 Flash Point 132.5 °C
Transport Information Appearance
Safety 26-36/37/39 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 87996-55-2 (Methanone,(4-chlorophenyl)[4-(trifluoromethoxy)phenyl]-) Hazard Symbols
Synonyms

(4-chlorophenyl)(4-(trifluoromethoxy)phenyl)methanone;(4-Chloro-phenyl)-(4-trifluoromethoxy-phenyl)-;4'-Chloro-4-trifluoromethoxybenzophenone;

 

4'-Chloro-4-trifluoromethoxybenzophenone Specification

This chemical is called 4'-Chloro-4-trifluoromethoxybenzophenone, and it can also be named as Methanone,(4-chlorophenyl)[4-(trifluoromethoxy)phenyl]-. With the molecular formula of C14H8ClF3O2, its molecular weight is 300.66. The CAS registry number of this chemical is 87996-55-2.

Other characteristics of the 4'-Chloro-4-trifluoromethoxybenzophenone can be summarised as followings: (1)ACD/LogP: 4.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.99; (4)ACD/LogD (pH 7.4): 4.99; (5)ACD/BCF (pH 5.5): 3642.94; (6)ACD/BCF (pH 7.4): 3642.94; (7)ACD/KOC (pH 5.5): 12327.68; (8)ACD/KOC (pH 7.4): 12327.68; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.531; (14)Molar Refractivity: 68.07 cm3; (15)Molar Volume: 219.8 cm3; (16)Polarizability: 26.98×10-24cm3; (17)Surface Tension: 37.2 dyne/cm; (18)Density: 1.367 g/cm3; (19)Flash Point: 132.5 °C; (20)Enthalpy of Vaporization: 58.87 kJ/mol; (21)Boiling Point: 344.7 °C at 760 mmHg; (22)Vapour Pressure: 6.45E-05 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: O=C(c1ccc(Cl)cc1)c2ccc(OC(F)(F)F)cc2
2.InChI: InChI=1/C14H8ClF3O2/c15-11-5-1-9(2-6-11)13(19)10-3-7-12(8-4-10)20-14(16,17)18/h1-8H
3.InChIKey: HKXKIYARIGTDNN-UHFFFAOYAO

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