ChemSpider 2D Image | (4beta,8alpha,9R)-9-Phenoxycinchonan | C25H26N2O

(4β,8α,9R)-9-Phenoxycinchonan

  • Molecular FormulaC25H26N2O
  • Average mass370.487 Da
  • Monoisotopic mass370.204498 Da
  • ChemSpider ID30658730

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(4β,8α,9R)-9-Phenoxycinchonan [German] [ACD/IUPAC Name]
(4β,8α,9R)-9-Phenoxycinchonan [ACD/IUPAC Name]
(4β,8α,9R)-9-Phénoxycinchonan [French] [ACD/IUPAC Name]
Cinchonan, 9-phenoxy-, (4β,8α,9R)- [ACD/Index 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: 523.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.7±3.0 kJ/mol
Flash Point: 270.2±25.9 °C
Index of Refraction: 1.653
Molar Refractivity: 114.3±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.21
ACD/LogD (pH 5.5): 2.01
ACD/BCF (pH 5.5): 3.81
ACD/KOC (pH 5.5): 12.80
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 87.05
ACD/KOC (pH 7.4): 292.19
Polar Surface Area: 25 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 312.2±5.0 cm3

Click to predict properties on the Chemicalize site


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