ChemSpider 2D Image | 1-(Dimethylamino)-3-[2-({[2-(2-fluorophenyl)ethyl]amino}methyl)-4-methoxyphenoxy]-2-propanol | C21H29FN2O3

1-(Dimethylamino)-3-[2-({[2-(2-fluorophenyl)ethyl]amino}methyl)-4-methoxyphenoxy]-2-propanol

  • Molecular FormulaC21H29FN2O3
  • Average mass376.465 Da
  • Monoisotopic mass376.216217 Da
  • ChemSpider ID22230262

More details:

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

1-(Dimethylamino)-3-[2-({[2-(2-fluorophenyl)ethyl]amino}methyl)-4-methoxyphenoxy]-2-propanol [ACD/IUPAC Name]
1-(Diméthylamino)-3-[2-({[2-(2-fluorophényl)éthyl]amino}méthyl)-4-méthoxyphénoxy]-2-propanol [French] [ACD/IUPAC Name]
1-(Dimethylamino)-3-[2-({[2-(2-fluorphenyl)ethyl]amino}methyl)-4-methoxyphenoxy]-2-propanol [German] [ACD/IUPAC Name]
2-Propanol, 1-(dimethylamino)-3-[2-[[[2-(2-fluorophenyl)ethyl]amino]methyl]-4-methoxyphenoxy]- [ACD/Index Name]
1-(DIMETHYLAMINO)-3-[2-({[2-(2-FLUOROPHENYL)ETHYL]AMINO}METHYL)-4-METHOXYPHENOXY]PROPAN-2-OL

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

Density: 1.1±0.1 g/cm3
Boiling Point: 517.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.1±3.0 kJ/mol
Flash Point: 266.7±30.1 °C
Index of Refraction: 1.550
Molar Refractivity: 105.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.83
ACD/LogD (pH 5.5): -1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.74
Polar Surface Area: 54 Å2
Polarizability: 41.9±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 331.7±3.0 cm3

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