ChemSpider 2D Image | 1,1'-[(4,10-Dimethyl-1,4,7,10-tetraazacyclododecane-1,7-diyl)bis(2-oxo-2,1-ethanediyl)]bis(3-hydroxy-2(1H)-pyridinone) | C24H34N6O6

1,1'-[(4,10-Dimethyl-1,4,7,10-tetraazacyclododecane-1,7-diyl)bis(2-oxo-2,1-ethanediyl)]bis(3-hydroxy-2(1H)-pyridinone)

  • Molecular FormulaC24H34N6O6
  • Average mass502.563 Da
  • Monoisotopic mass502.253998 Da
  • ChemSpider ID68005706

More details:

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

1,1'-[(4,10-Dimethyl-1,4,7,10-tetraazacyclododecan-1,7-diyl)bis(2-oxo-2,1-ethandiyl)]bis(3-hydroxy-2(1H)-pyridinon) [German] [ACD/IUPAC Name]
1,1'-[(4,10-Dimethyl-1,4,7,10-tetraazacyclododecane-1,7-diyl)bis(2-oxo-2,1-ethanediyl)]bis(3-hydroxy-2(1H)-pyridinone) [ACD/IUPAC Name]
1,1'-[(4,10-Diméthyl-1,4,7,10-tétraazacyclododécane-1,7-diyl)bis(2-oxo-2,1-éthanediyl)]bis(3-hydroxy-2(1H)-pyridinone) [French] [ACD/IUPAC Name]
2(1H)-Pyridinone, 1,1'-[(4,10-dimethyl-1,4,7,10-tetraazacyclododecane-1,7-diyl)bis(2-oxo-2,1-ethanediyl)]bis[3-hydroxy- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 818.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.3±6.0 kJ/mol
Flash Point: 448.5±34.3 °C
Index of Refraction: 1.595
Molar Refractivity: 130.1±0.3 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.51
ACD/LogD (pH 5.5): -5.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability: 51.6±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 382.8±3.0 cm3

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