ChemSpider 2D Image | 1-{[2-(4-Fluorophenyl)-2-hydroxyethyl](methyl)amino}-3-methoxy-2-propanol | C13H20FNO3

1-{[2-(4-Fluorophenyl)-2-hydroxyethyl](methyl)amino}-3-methoxy-2-propanol

  • Molecular FormulaC13H20FNO3
  • Average mass257.301 Da
  • Monoisotopic mass257.142731 Da
  • ChemSpider ID30226078

More details:

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

1-{[2-(4-Fluorophenyl)-2-hydroxyethyl](methyl)amino}-3-methoxy-2-propanol [ACD/IUPAC Name]
1-{[2-(4-Fluorophényl)-2-hydroxyéthyl](méthyl)amino}-3-méthoxy-2-propanol [French] [ACD/IUPAC Name]
1-{[2-(4-Fluorphenyl)-2-hydroxyethyl](methyl)amino}-3-methoxy-2-propanol [German] [ACD/IUPAC Name]
Benzenemethanol, 4-fluoro-α-[[(2-hydroxy-3-methoxypropyl)methylamino]methyl]- [ACD/Index Name]
1-(4-FLUOROPHENYL)-2-[(2-HYDROXY-3-METHOXYPROPYL)(METHYL)AMINO]ETHAN-1-OL
1-(4-FLUOROPHENYL)-2-[(2-HYDROXY-3-METHOXYPROPYL)(METHYL)AMINO]ETHANOL

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

Density: 1.2±0.1 g/cm3
Boiling Point: 381.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 66.4±3.0 kJ/mol
Flash Point: 184.4±27.9 °C
Index of Refraction: 1.529
Molar Refractivity: 67.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): -1.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 29.57
Polar Surface Area: 53 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 44.4±3.0 dyne/cm
Molar Volume: 218.7±3.0 cm3

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