1-(3-FLUOROPHENYL)IMIDAZOLE

The product 1H-Imidazole,1-(3-fluorophenyl)-, with the CAS registry number 25372-42-3, is also known as 1-(3-Fluorophenyl)imidazole. It belongs to the product category of Imidazol&Benzimidazole. This chemical's molecular formula is C₉H₇FN₂ and molecular weight is 162.16. What's more, its systematic name is 1-(3-Fluorophenyl)-1H-imidazole. 

Physical properties about this chemical are: (1)ACD/LogP: 2.03; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.77; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 11.21; (6)ACD/BCF (pH 7.4): 20.4; (7)ACD/KOC (pH 5.5): 165.05; (8)ACD/KOC (pH 7.4): 300.38; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.82 Å²; (13)Index of Refraction: 1.574; (14)Molar Refractivity: 45.8 cm³; (15)Molar Volume: 138.7 cm³; (16)Polarizability: 18.15×10^-24cm³; (17)Surface Tension: 38.8 dyne/cm; (18)Density: 1.16 g/cm³; (19)Flash Point: 123.9 °C; (20)Enthalpy of Vaporization: 49.92 kJ/mol; (21)Boiling Point: 281.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00614 mmHg at 25 °C.

Preparation of the 1H-Imidazole,1-(3-fluorophenyl): this chemical can be produced by 1-(3-Fluoro-phenyl)-1,3-dihydro-imidazole-2-thione. This reaction needs reagent 20 percent HNO₃. The yield is 20 %.

When you are dealing with this chemical, you should be very careful. This chemical is irritating to eyes, respiratory system and skin. Therefore, you should wear suitable protective clothing. And in case of contacting with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1cccc(c1)n2ccnc2
(2) InChI: InChI=1/C9H7FN2/c10-8-2-1-3-9(6-8)12-5-4-11-7-12/h1-7H
(3) InChIKey: SQJDRLQZCRNMQU-UHFFFAOYAY