ChemSpider 2D Image | N-(26-Amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanamide | C37H53N3O10

N-(26-Amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanamide

  • Molecular FormulaC37H53N3O10
  • Average mass699.831 Da
  • Monoisotopic mass699.373108 Da
  • ChemSpider ID129158270

More details:

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

Dibenz[b,f]azocine-5(6H)-butanamide, N-(26-amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-11,12-didehydro-γ-oxo- [ACD/Index Name]
N-(26-Amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanamid [German] [ACD/IUPAC Name]
N-(26-Amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-4-(11,12-didehydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanamide [ACD/IUPAC Name]
N-(26-Amino-3,6,9,12,15,18,21,24-octaoxahexacos-1-yl)-4-(11,12-didéhydrodibenzo[b,f]azocin-5(6H)-yl)-4-oxobutanamide [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 863.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 125.4±3.0 kJ/mol
Flash Point: 475.8±34.3 °C
Index of Refraction: 1.567
Molar Refractivity: 188.5±0.4 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 0.27
ACD/LogD (pH 5.5): -1.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.15
Polar Surface Area: 149 Å2
Polarizability: 74.7±0.5 10-24cm3
Surface Tension: 56.3±5.0 dyne/cm
Molar Volume: 577.1±5.0 cm3

Click to predict properties on the Chemicalize site


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