ChemSpider 2D Image | 1-(Diethylamino)-3-[4-({[2-(4,6-dimethyl-2-pyrimidinyl)ethyl]amino}methyl)-2-methoxyphenoxy]-2-propanol | C23H36N4O3

1-(Diethylamino)-3-[4-({[2-(4,6-dimethyl-2-pyrimidinyl)ethyl]amino}methyl)-2-methoxyphenoxy]-2-propanol

  • Molecular FormulaC23H36N4O3
  • Average mass416.557 Da
  • Monoisotopic mass416.278748 Da
  • ChemSpider ID22143624

More details:

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

1-(Diethylamino)-3-[4-({[2-(4,6-dimethyl-2-pyrimidinyl)ethyl]amino}methyl)-2-methoxyphenoxy]-2-propanol [ACD/IUPAC Name]
1-(Diethylamino)-3-[4-({[2-(4,6-dimethyl-2-pyrimidinyl)ethyl]amino}methyl)-2-methoxyphenoxy]-2-propanol [German] [ACD/IUPAC Name]
1-(Diéthylamino)-3-[4-({[2-(4,6-diméthyl-2-pyrimidinyl)éthyl]amino}méthyl)-2-méthoxyphénoxy]-2-propanol [French] [ACD/IUPAC Name]
2-Propanol, 1-(diethylamino)-3-[4-[[[2-(4,6-dimethyl-2-pyrimidinyl)ethyl]amino]methyl]-2-methoxyphenoxy]- [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: 570.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 90.0±3.0 kJ/mol
Flash Point: 298.5±30.1 °C
Index of Refraction: 1.549
Molar Refractivity: 120.7±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 2.69
ACD/LogD (pH 5.5): -1.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.38
Polar Surface Area: 80 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 379.5±3.0 cm3

Click to predict properties on the Chemicalize site


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