ChemSpider 2D Image | 9-Phenyl-N-{(1R)-2-phenyl-1-[(4R,4'R,5S)-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxol-5-yl]ethyl}-9H-fluoren-9-amine | C37H39NO4

9-Phenyl-N-{(1R)-2-phenyl-1-[(4R,4'R,5S)-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxol-5-yl]ethyl}-9H-fluoren-9-amine

  • Molecular FormulaC37H39NO4
  • Average mass561.710 Da
  • Monoisotopic mass561.287903 Da
  • ChemSpider ID9332377

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

9-Phenyl-N-{(1R)-2-phenyl-1-[(4R,4'R,5S)-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxol-5-yl]ethyl}-9H-fluoren-9-amin [German] [ACD/IUPAC Name]
9-Phenyl-N-{(1R)-2-phenyl-1-[(4R,4'R,5S)-2,2,2',2'-tetramethyl-4,4'-bi-1,3-dioxol-5-yl]ethyl}-9H-fluoren-9-amine [ACD/IUPAC Name]
9-Phényl-N-{(1R)-2-phényl-1-[(4R,4'R,5S)-2,2,2',2'-tétraméthyl-4,4'-bi-1,3-dioxol-5-yl]éthyl}-9H-fluorén-9-amine [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 656.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.7±3.0 kJ/mol
Flash Point: 292.3±21.0 °C
Index of Refraction: 1.644
Molar Refractivity: 165.5±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 8.21
ACD/LogD (pH 5.5): 7.24
ACD/BCF (pH 5.5): 151546.80
ACD/KOC (pH 5.5): 137889.78
ACD/LogD (pH 7.4): 7.62
ACD/BCF (pH 7.4): 363697.22
ACD/KOC (pH 7.4): 330921.75
Polar Surface Area: 49 Å2
Polarizability: 65.6±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 457.0±5.0 cm3

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