ChemSpider 2D Image | N,N'-(Iminodi-3,1-propanediyl)bis[4-(3-methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl)butanamide] | C36H41N3O6

N,N'-(Iminodi-3,1-propanediyl)bis[4-(3-methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl)butanamide]

  • Molecular FormulaC36H41N3O6
  • Average mass611.727 Da
  • Monoisotopic mass611.299561 Da
  • ChemSpider ID8707204

More details:

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

2-Naphthalenebutanamide, N,N'-(iminodi-3,1-propanediyl)bis[1,4-dihydro-3-methyl-1,4-dioxo- [ACD/Index Name]
N,N'-(Iminodi-3,1-propandiyl)bis[4-(3-methyl-1,4-dioxo-1,4-dihydro-2-naphthalinyl)butanamid] [German] [ACD/IUPAC Name]
N,N'-(Iminodi-3,1-propanediyl)bis[4-(3-méthyl-1,4-dioxo-1,4-dihydro-2-naphtalényl)butanamide] [French] [ACD/IUPAC Name]
N,N'-(Iminodi-3,1-propanediyl)bis[4-(3-methyl-1,4-dioxo-1,4-dihydro-2-naphthalenyl)butanamide] [ACD/IUPAC Name]
N,N'-(iminodipropane-3,1-diyl)bis[4-(3-methyl-1,4-dioxo-1,4-dihydronaphthalen-2-yl)butanamide]
4-(3-Methyl-1,4-dioxo-1,4-dihydro-naphthalen-2-yl)-N-(3-{3-[4-(3-methyl-1,4-dioxo-1,4-dihydro-naphthalen-2-yl)-butyrylamino]-propylamino}-propyl)-butyramide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 886.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 128.9±3.0 kJ/mol
Flash Point: 218.7±34.4 °C
Index of Refraction: 1.578
Molar Refractivity: 169.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.51
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 1.35
ACD/KOC (pH 7.4): 9.91
Polar Surface Area: 139 Å2
Polarizability: 67.0±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 509.4±3.0 cm3

Click to predict properties on the Chemicalize site


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