ChemSpider 2D Image | 2,2,6,6-Tetramethyl-4-piperidinyl 4-(1-pyrenyl)butanoate | C29H33NO2

2,2,6,6-Tetramethyl-4-piperidinyl 4-(1-pyrenyl)butanoate

  • Molecular FormulaC29H33NO2
  • Average mass427.578 Da
  • Monoisotopic mass427.251129 Da
  • ChemSpider ID28568074

More details:

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

1-Pyrenebutanoic acid, 2,2,6,6-tetramethyl-4-piperidinyl ester [ACD/Index Name]
2,2,6,6-Tetramethyl-4-piperidinyl 4-(1-pyrenyl)butanoate [ACD/IUPAC Name]
2,2,6,6-Tetramethyl-4-piperidinyl-4-(1-pyrenyl)butanoat [German] [ACD/IUPAC Name]
4-(1-Pyrényl)butanoate de 2,2,6,6-tétraméthyl-4-pipéridinyle [French] [ACD/IUPAC Name]
194664-21-6 [RN]
2,2,6,6-Tetramethylpiperidin-4-yl 4-(pyren-1-yl)butanoate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 571.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.7±3.0 kJ/mol
Flash Point: 299.5±30.1 °C
Index of Refraction: 1.654
Molar Refractivity: 135.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.99
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 161.50
ACD/KOC (pH 5.5): 175.52
ACD/LogD (pH 7.4): 4.66
ACD/BCF (pH 7.4): 483.33
ACD/KOC (pH 7.4): 525.32
Polar Surface Area: 38 Å2
Polarizability: 53.6±0.5 10-24cm3
Surface Tension: 50.8±5.0 dyne/cm
Molar Volume: 369.2±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement