The N-(2-Nitrophenyl)piperidine-4-carboxamide is an organic compound with the formula C12H15N3O4. The systematic name of this chemical is N-(4-nitrophenyl)piperidine-4-carboxamide. With the CAS registry number 883106-60-3, it is also named as 4-piperidinecarboxamide, N-(4-nitrophenyl)-.
Physical properties about N-(2-Nitrophenyl)piperidine-4-carboxamide are: (1)ACD/LogP: 1.86 ; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 6; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 3; (9)Polar Surface Area: 86.95 Å2; (10)Index of Refraction: 1.607; (11)Molar Refractivity: 66.7 cm3; (12)Molar Volume: 192.9 cm3; (13)Polarizability: 26.44×10-24cm3; (14)Surface Tension: 57.5 dyne/cm; (15)Density: 1.292 g/cm3; (16)Flash Point: 253 °C; (17)Enthalpy of Vaporization: 76.22 kJ/mol; (18)Boiling Point: 494.8 °C at 760 mmHg; (19)Vapour Pressure: 6.25E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(ccc1NC(=O)C2CCNCC2)[N+](=O)[O-]CopyCopied; (2)InChI: InChI=1/C12H15N3O3/c16-12(9-5-7-13-8-6-9)14-10-1-3-11(4-2-10)15(17)18/h1-4,9,13H,5-8H2,(H,14,16) CopyCopied; (3)InChIKey: JFBDQUQRCYWIMW-UHFFFAOYAW; (4)Std. InChI: InChI=1S/C12H15N3O3/c16-12(9-5-7-13-8-6-9)14-10-1-3-11(4-2-10)15(17)18/h1-4,9,13H,5-8H2,(H,14,16) CopyCopied; (5)Std. InChIKey: JFBDQUQRCYWIMW-UHFFFAOYSA-N.
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