ChemSpider 2D Image | 1-[(2R,6R)-2,6-Dimethyl-4-morpholinyl]-3-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1-propanone | C23H37NO3

1-[(2R,6R)-2,6-Dimethyl-4-morpholinyl]-3-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1-propanone

  • Molecular FormulaC23H37NO3
  • Average mass375.545 Da
  • Monoisotopic mass375.277344 Da
  • ChemSpider ID62333950

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

1-[(2R,6R)-2,6-Dimethyl-4-morpholinyl]-3-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1-propanon [German] [ACD/IUPAC Name]
1-[(2R,6R)-2,6-Dimethyl-4-morpholinyl]-3-[4-hydroxy-3,5-bis(2-methyl-2-propanyl)phenyl]-1-propanone [ACD/IUPAC Name]
1-[(2R,6R)-2,6-Diméthyl-4-morpholinyl]-3-[4-hydroxy-3,5-bis(2-méthyl-2-propanyl)phényl]-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 3-[3,5-bis(1,1-dimethylethyl)-4-hydroxyphenyl]-1-[(2R,6R)-2,6-dimethyl-4-morpholinyl]- [ACD/Index 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: 478.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.1±3.0 kJ/mol
Flash Point: 243.4±28.7 °C
Index of Refraction: 1.508
Molar Refractivity: 110.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.52
ACD/LogD (pH 5.5): 5.20
ACD/BCF (pH 5.5): 5302.69
ACD/KOC (pH 5.5): 16128.23
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5302.64
ACD/KOC (pH 7.4): 16128.07
Polar Surface Area: 50 Å2
Polarizability: 43.6±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 368.8±3.0 cm3

Click to predict properties on the Chemicalize site


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