The N-Benzyl-1-(4-fluorophenyl)-2-methyl-2-aminopropane is an organic compound with the formula C17H20FN. The IUPAC name of this chemical is N-benzyl-1-(4-fluorophenyl)-2-methylpropan-2-amine. With the CAS registry number 4116-02-3, it is also named as benzeneethanamine, 4-fluoro-α,α-dimethyl-N-(phenylmethyl)-.
Physical properties about N-Benzyl-1-(4-fluorophenyl)-2-methyl-2-aminopropane are: (1)ACD/LogP: 4.33; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.545; (7)Molar Refractivity: 77.74 cm3; (8)Molar Volume: 245.5 cm3; (9)Polarizability: 30.81×10-24cm3; (10)Surface Tension: 36.9 dyne/cm; (11)Density: 1.048 g/cm3; (12)Flash Point: 167.5 °C; (13)Enthalpy of Vaporization: 59.83 kJ/mol; (14)Boiling Point: 353.4 °C at 760 mmHg; (15)Vapour Pressure: 3.59E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Fc1ccc(cc1)CC(NCc2ccccc2)(C)C
(2)InChI: InChI=1/C17H20FN/c1-17(2,12-14-8-10-16(18)11-9-14)19-13-15-6-4-3-5-7-15/h3-11,19H,12-13H2,1-2H3
(3)InChIKey: XMSVIQAYDXJYIX-UHFFFAOYAZ
(4)Std. InChI: InChI=1S/C17H20FN/c1-17(2,12-14-8-10-16(18)11-9-14)19-13-15-6-4-3-5-7-15/h3-11,19H,12-13H2,1-2H3
(5)Std. InChIKey: XMSVIQAYDXJYIX-UHFFFAOYSA-N
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