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774535-95-4

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Basic Information
CAS No.: 774535-95-4
Name: PIPERIDINE-3-CARBOXYLIC ACID (4-NITRO-PHENYL)-AMIDE
Molecular Structure:
Molecular Structure of 774535-95-4 (PIPERIDINE-3-CARBOXYLIC ACID (4-NITRO-PHENYL)-AMIDE)
Formula: C12H15 N3 O3
Molecular Weight: 249.27
Synonyms: Piperidine-3-carboxylic acid (4-nitrophenyl)amide
Density: 1.292±0.06 g/cm3(Predicted)
Boiling Point: 494.8±40.0 °C(Predicted)
PSA: 86.95000
LogP: 2.45790
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    Molecular Formula: C12H15N3O3 Formula Weight: 249.27

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Chemistry

Molecular Structure of N-(4-Nitrophenyl)piperidine-3-carboxamide (CAS No.774535-95-4):

Molecular Formula: C12H15N3O3
Molecular Weight: 249.27
CAS No: 774535-95-4
Product Categories: Amide
H bond acceptors: 6
H bond donors: 2
Freely Rotating Bonds: 3
Polar Surface Area: 86.95 Å2
Index of Refraction: 1.607
Molar Refractivity: 66.7 cm3
Molar Volume: 192.9 cm3
Surface Tension: 57.5 dyne/cm
Density: 1.292 g/cm3
Flash Point: 253 °C
Enthalpy of Vaporization: 76.22 kJ/mol
Boiling Point: 494.8 °C at 760 mmHg
Vapour Pressure: 6.25E-10 mmHg at 25°C
Systematic Name: N-(4-Nitrophenyl)piperidine-3-carboxamide
InChI: InChI=1/C12H15N3O3/c16-12(9-2-1-7-13-8-9)14-10-3-5-11(6-4-10)15(17)18/h3-6,9,13H,1-2,7-8H2,(H,14,16)
InChIKey: PNPWZWHXQLOTRJ-UHFFFAOYAL
Std. InChI: InChI=1S/C12H15N3O3/c16-12(9-2-1-7-13-8-9)14-10-3-5-11(6-4-10)15(17)18/h3-6,9,13H,1-2,7-8H2,(H,14,16)
Std. InChIKey: PNPWZWHXQLOTRJ-UHFFFAOYSA-N

Specification

  N-(4-Nitrophenyl)piperidine-3-carboxamide (CAS No.774535-95-4), it also can be called Piperidine-3-carboxylic acid (4-nitrophenyl)amide ; 3-Piperidinecarboxamide, N-(4-nitrophenyl)- .