ChemSpider 2D Image | (2R)-1-[Cyclohexyl(phenyl)methoxy]-3-{[2-methyl-1-(2-naphthyl)-2-propanyl]amino}-2-propanol | C30H39NO2

(2R)-1-[Cyclohexyl(phenyl)methoxy]-3-{[2-methyl-1-(2-naphthyl)-2-propanyl]amino}-2-propanol

  • Molecular FormulaC30H39NO2
  • Average mass445.636 Da
  • Monoisotopic mass445.298065 Da
  • ChemSpider ID24662718

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(2R)-1-[Cyclohexyl(phenyl)methoxy]-3-{[2-methyl-1-(2-naphthyl)-2-propanyl]amino}-2-propanol [German] [ACD/IUPAC Name]
(2R)-1-[Cyclohexyl(phenyl)methoxy]-3-{[2-methyl-1-(2-naphthyl)-2-propanyl]amino}-2-propanol [ACD/IUPAC Name]
(2R)-1-[Cyclohexyl(phényl)méthoxy]-3-{[2-méthyl-1-(2-naphtyl)-2-propanyl]amino}-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-(cyclohexylphenylmethoxy)-3-[[1,1-dimethyl-2-(2-naphthalenyl)ethyl]amino]-, (2R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 601.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 317.7±30.1 °C
Index of Refraction: 1.592
Molar Refractivity: 138.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 7.41
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 167.26
ACD/KOC (pH 5.5): 194.97
ACD/LogD (pH 7.4): 5.49
ACD/BCF (pH 7.4): 3559.34
ACD/KOC (pH 7.4): 4149.00
Polar Surface Area: 41 Å2
Polarizability: 54.9±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 409.0±3.0 cm3

Click to predict properties on the Chemicalize site


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