N-(4-Bromophenyl)piperidine-3-carboxamide (749846-52-4)

The cas register number of N-(4-Bromophenyl)piperidine-3-carboxamide is 749846-52-4. It also can be called as Piperidine-3-carboxylic acid (4-bromophenyl)amide and the Systematic name about this chemical is N-(4-bromophenyl)piperidine-3-carboxamide.

Physical properties about N-(4-Bromophenyl)piperidine-3-carboxamide are: (1)ACD/LogP: 2.54; (2)ACD/LogD (pH 7.4): 0.07; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1.95; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 41.13Ų; (11)Index of Refraction: 1.604; (12)Molar Refractivity: 67.84 cm³; (13)Molar Volume: 197.2 cm³; (14)Polarizability: 26.89x10^-24cm³; (15)Surface Tension: 50.2 dyne/cm; (16)Enthalpy of Vaporization: 71 kJ/mol; (17)Boiling Point: 451 °C at 760 mmHg; (18)Vapour Pressure: 2.51E-08 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(Nc1ccc(Br)cc1)C2CNCCC2
(2)InChI: InChI=1/C12H15BrN2O/c13-10-3-5-11(6-4-10)15-12(16)9-2-1-7-14-8-9/h3-6,9,14H,1-2,7-8H2,(H,15,16)
(3)InChIKey: DZJJDGDAVXYXJX-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C12H15BrN2O/c13-10-3-5-11(6-4-10)15-12(16)9-2-1-7-14-8-9/h3-6,9,14H,1-2,7-8H2,(H,15,16)
(5)Std. InChIKey: DZJJDGDAVXYXJX-UHFFFAOYSA-N