ChemSpider 2D Image | N-[1-(2-Chloropropanoyl)-4-piperidinyl]-4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide | C20H23ClN4O6

N-[1-(2-Chloropropanoyl)-4-piperidinyl]-4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide

  • Molecular FormulaC20H23ClN4O6
  • Average mass450.873 Da
  • Monoisotopic mass450.130615 Da
  • ChemSpider ID32456024

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-Isoindole-2-butanamide, N-[1-(2-chloro-1-oxopropyl)-4-piperidinyl]-1,3-dihydro-5-nitro-1,3-dioxo- [ACD/Index Name]
N-[1-(2-Chloropropanoyl)-4-piperidinyl]-4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide [ACD/IUPAC Name]
N-[1-(2-Chloropropanoyl)-4-pipéridinyl]-4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamide [French] [ACD/IUPAC Name]
N-[1-(2-Chlorpropanoyl)-4-piperidinyl]-4-(5-nitro-1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)butanamid [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 714.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.4±3.0 kJ/mol
Flash Point: 385.6±32.9 °C
Index of Refraction: 1.622
Molar Refractivity: 110.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 1.13
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 6.98
ACD/KOC (pH 5.5): 139.81
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 6.98
ACD/KOC (pH 7.4): 139.81
Polar Surface Area: 133 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 67.7±5.0 dyne/cm
Molar Volume: 312.8±5.0 cm3

Click to predict properties on the Chemicalize site


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