ChemSpider 2D Image | Bis(2-methyl-2-propanyl) 1-oxo-1,3-dihydroazepino[3,4-b]indole-2,10-dicarboxylate | C22H26N2O5

Bis(2-methyl-2-propanyl) 1-oxo-1,3-dihydroazepino[3,4-b]indole-2,10-dicarboxylate

  • Molecular FormulaC22H26N2O5
  • Average mass398.452 Da
  • Monoisotopic mass398.184174 Da
  • ChemSpider ID30658608

More details:

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

1-Oxo-1,3-dihydroazépino[3,4-b]indole-2,10-dicarboxylate de bis(2-méthyl-2-propanyle) [French] [ACD/IUPAC Name]
Azepino[3,4-b]indole-2,10-dicarboxylic acid, 1,3-dihydro-1-oxo-, bis(1,1-dimethylethyl) ester [ACD/Index Name]
Bis(2-methyl-2-propanyl) 1-oxo-1,3-dihydroazepino[3,4-b]indole-2,10-dicarboxylate [ACD/IUPAC Name]
Bis(2-methyl-2-propanyl)-1-oxo-1,3-dihydroazepino[3,4-b]indol-2,10-dicarboxylat [German] [ACD/IUPAC Name]
2,10-di-tert-butyl 1-oxo-1H,2H,3H,10H-azepino[3,4-b]indole-2,10-dicarboxylate
519033-28-4 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 525.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.8±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 109.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.97
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 643.71
ACD/KOC (pH 5.5): 3565.00
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 643.71
ACD/KOC (pH 7.4): 3565.00
Polar Surface Area: 78 Å2
Polarizability: 43.4±0.5 10-24cm3
Surface Tension: 42.0±7.0 dyne/cm
Molar Volume: 333.0±7.0 cm3

Click to predict properties on the Chemicalize site


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