ChemSpider 2D Image | 1-{[4'-Fluoro-3'-(hydroxymethyl)-2-biphenylyl]oxy}-3-(1-piperidinyl)-2-propanol | C21H26FNO3

1-{[4'-Fluoro-3'-(hydroxymethyl)-2-biphenylyl]oxy}-3-(1-piperidinyl)-2-propanol

  • Molecular FormulaC21H26FNO3
  • Average mass359.434 Da
  • Monoisotopic mass359.189667 Da
  • ChemSpider ID30956105

More details:

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

1-{[4'-Fluor-3'-(hydroxymethyl)-2-biphenylyl]oxy}-3-(1-piperidinyl)-2-propanol [German] [ACD/IUPAC Name]
1-{[4'-Fluoro-3'-(hydroxymethyl)-2-biphenylyl]oxy}-3-(1-piperidinyl)-2-propanol [ACD/IUPAC Name]
1-{[4'-Fluoro-3'-(hydroxyméthyl)-2-biphénylyl]oxy}-3-(1-pipéridinyl)-2-propanol [French] [ACD/IUPAC Name]
1-Piperidineethanol, α-[[[4'-fluoro-3'-(hydroxymethyl)[1,1'-biphenyl]-2-yl]oxy]methyl]- [ACD/Index Name]
1-{[4'-fluoro-3'-(hydroxymethyl)biphenyl-2-yl]oxy}-3-piperidin-1-ylpropan-2-ol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 528.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 273.4±30.1 °C
Index of Refraction: 1.574
Molar Refractivity: 99.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 0.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.18
ACD/LogD (pH 7.4): 1.44
ACD/BCF (pH 7.4): 3.07
ACD/KOC (pH 7.4): 27.67
Polar Surface Area: 53 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 47.6±3.0 dyne/cm
Molar Volume: 301.2±3.0 cm3

Click to predict properties on the Chemicalize site


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