ChemSpider 2D Image | 2,5-di-tert-butyl 2,5-diazabicyclo[2.2.2]octane-2,5-dicarboxylate | C16H28N2O4

2,5-di-tert-butyl 2,5-diazabicyclo[2.2.2]octane-2,5-dicarboxylate

  • Molecular FormulaC16H28N2O4
  • Average mass312.405 Da
  • Monoisotopic mass312.204895 Da
  • ChemSpider ID32674326

More details:

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

1632286-19-1 [RN]
2,5-Diazabicyclo[2.2.2]octane-2,5-dicarboxylate de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
2,5-Diazabicyclo[2.2.2]octane-2,5-dicarboxylic acid, 2,5-bis(1,1-dimethylethyl) ester
2,5-Diazabicyclo[2.2.2]octane-2,5-dicarboxylic acid, bis(1,1-dimethylethyl) ester [ACD/Index Name]
2,5-di-tert-butyl 2,5-diazabicyclo[2.2.2]octane-2,5-dicarboxylate
Bis(2-methyl-2-propanyl) 2,5-diazabicyclo[2.2.2]octane-2,5-dicarboxylate [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-2,5-diazabicyclo[2.2.2]octan-2,5-dicarboxylat [German] [ACD/IUPAC Name]
2,5-Diaza-bicyclo[2.2.2]octane-2,5-dicarboxylic acid di-tert-butyl ester
Di-tert-butyl 2,5-diazabicyclo[2.2.2]octane-2,5-dicarboxylate
MFCD28144820

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

Density: 1.1±0.1 g/cm3
Boiling Point: 384.2±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.3±3.0 kJ/mol
Flash Point: 186.2±20.9 °C
Index of Refraction: 1.502
Molar Refractivity: 82.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 73.08
ACD/KOC (pH 5.5): 751.11
ACD/LogD (pH 7.4): 2.76
ACD/BCF (pH 7.4): 73.08
ACD/KOC (pH 7.4): 751.11
Polar Surface Area: 59 Å2
Polarizability: 32.7±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 279.4±3.0 cm3

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