ChemSpider 2D Image | 2-Methyl-2-propanyl 2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-octyl-4,5-dipropyl-2,3-dihydro-1H-pyrrole-1-carboxylate | C28H52N2O4

2-Methyl-2-propanyl 2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-octyl-4,5-dipropyl-2,3-dihydro-1H-pyrrole-1-carboxylate

  • Molecular FormulaC28H52N2O4
  • Average mass480.724 Da
  • Monoisotopic mass480.392700 Da
  • ChemSpider ID75542731

More details:

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

1H-Pyrrole-1-carboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-2,3-dihydro-3-octyl-4,5-dipropyl-, 1,1-dimethylethyl ester [ACD/Index Name]
2-({[(2-Méthyl-2-propanyl)oxy]carbonyl}amino)-3-octyl-4,5-dipropyl-2,3-dihydro-1H-pyrrole-1-carboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
2-Methyl-2-propanyl 2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-octyl-4,5-dipropyl-2,3-dihydro-1H-pyrrole-1-carboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-2-({[(2-methyl-2-propanyl)oxy]carbonyl}amino)-3-octyl-4,5-dipropyl-2,3-dihydro-1H-pyrrol-1-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 557.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 291.2±30.1 °C
Index of Refraction: 1.493
Molar Refractivity: 140.3±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 9.40
ACD/LogD (pH 5.5): 8.82
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1498913.25
ACD/LogD (pH 7.4): 8.82
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1498671.25
Polar Surface Area: 68 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 37.7±5.0 dyne/cm
Molar Volume: 482.8±5.0 cm3

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