ChemSpider 2D Image | 1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetrayltetra-2,1-ethanediyl tetrakis(phenylcarbamate) | C44H56N8O8

1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetrayltetra-2,1-ethanediyl tetrakis(phenylcarbamate)

  • Molecular FormulaC44H56N8O8
  • Average mass824.964 Da
  • Monoisotopic mass824.422119 Da
  • ChemSpider ID21121028

More details:

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

1,4,7,10-Tetraazacyclododecan-1,4,7,10-tetrayltetra-2,1-ethandiyl-tetrakis(phenylcarbamat) [German] [ACD/IUPAC Name]
1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetraethanol, tetrakis(phenylcarbamate) (ester) [ACD/Index Name]
1,4,7,10-Tetraazacyclododecane-1,4,7,10-tetrayltetra-2,1-ethanediyl tetrakis(phenylcarbamate) [ACD/IUPAC Name]
Tétrakis(phénylcarbamate) de 1,4,7,10-tétraazacyclododécane-1,4,7,10-tétrayltetra-2,1-éthanediyle [French] [ACD/IUPAC Name]
1,4,7,10-Tetra(phenylaminocarbonyloxyethyl)-1,4,7,10-tetraazacyclododecane

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

Density: 1.2±0.1 g/cm3
Boiling Point: 936.9±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 142.8±3.0 kJ/mol
Flash Point: 520.4±37.1 °C
Index of Refraction: 1.598
Molar Refractivity: 229.6±0.5 cm3
#H bond acceptors: 16
#H bond donors: 4
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 7.61
ACD/LogD (pH 5.5): 1.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.42
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.48
Polar Surface Area: 180 Å2
Polarizability: 91.0±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 673.0±7.0 cm3

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