4-Fluoro-4'-methylbenzophenone supplier

Name
4-Fluoro-4'-methylbenzophenone
EINECS 200-158-5
CAS No. 530-46-1
Article Data55
CAS DataBase
Density 1.139 g/cm³
Solubility
Melting Point 98-99 °C
Formula C₁₄H₁₁FO
Boiling Point 334.8 °C at 760 mmHg
Molecular Weight 214.239
Flash Point 147.9 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzophenone,4-fluoro-4'-methyl- (6CI,7CI,8CI);4-Fluoro-4'-methylbenzophenone;
PSA 17.07000
LogP 3.36510

4-Fluoro-4'-methylbenzophenone Specification

The 4-Fluoro-4'-methylbenzophenone with the cas number 530-46-1 is also called Methanone,(4-fluorophenyl)(4-methylphenyl)-. The systematic name is (4-fluorophenyl)(4-methylphenyl)methanone. Its molecular formula is C₁₄H₁₁FO. The product category is Aromatic Benzophenones & Derivatives (substituted).

The properties of the chemical are: (1)ACD/LogP: 3.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.86; (4)ACD/LogD (pH 7.4): 3.86; (5)ACD/BCF (pH 5.5): 506.06; (6)ACD/BCF (pH 7.4): 506.06; (7)ACD/KOC (pH 5.5): 3001.03; (8)ACD/KOC (pH 7.4): 3001.03; (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: 1.56; (14)Molar Refractivity: 60.86 cm³; (15)Molar Volume: 188 cm³; (16)Polarizability: 24.12×10^-24cm³; (17)Surface Tension: 39.5 dyne/cm; (18)Enthalpy of Vaporization: 57.78 kJ/mol; (19)Vapour Pressure: 0.000125 mmHg at 25°C.

Preparation: This chemical can be prepared by the reaction of 4-methyl-benzoyl chloride and fluorobenzene. The yield is 85.2%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1ccc(F)cc1)c2ccc(cc2)C
(2)InChI: InChI=1/C14H11FO/c1-10-2-4-11(5-3-10)14(16)12-6-8-13(15)9-7-12/h2-9H,1H3
(3)InChIKey: SLMBDAUYJQQTRF-UHFFFAOYAO

Product Name

4-Fluoro-4'-methylbenzophenone

4-Fluoro-4'-methylbenzophenone Specification

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