ChemSpider 2D Image | [1-(2,3-Dihydro-1,4-benzodioxin-6-ylmethyl)-4-(3-fluorobenzyl)-4-piperidinyl]methanol | C22H26FNO3

[1-(2,3-Dihydro-1,4-benzodioxin-6-ylmethyl)-4-(3-fluorobenzyl)-4-piperidinyl]methanol

  • Molecular FormulaC22H26FNO3
  • Average mass371.445 Da
  • Monoisotopic mass371.189667 Da
  • ChemSpider ID22119612

More details:

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

[1-(2,3-Dihydro-1,4-benzodioxin-6-ylmethyl)-4-(3-fluorbenzyl)-4-piperidinyl]methanol [German] [ACD/IUPAC Name]
[1-(2,3-Dihydro-1,4-benzodioxin-6-ylmethyl)-4-(3-fluorobenzyl)-4-piperidinyl]methanol [ACD/IUPAC Name]
[1-(2,3-Dihydro-1,4-benzodioxin-6-ylméthyl)-4-(3-fluorobenzyl)-4-pipéridinyl]méthanol [French] [ACD/IUPAC Name]
4-Piperidinemethanol, 1-[(2,3-dihydro-1,4-benzodioxin-6-yl)methyl]-4-[(3-fluorophenyl)methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 488.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.5±3.0 kJ/mol
Flash Point: 249.2±28.7 °C
Index of Refraction: 1.584
Molar Refractivity: 101.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 0.87
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.11
ACD/LogD (pH 7.4): 2.51
ACD/BCF (pH 7.4): 26.22
ACD/KOC (pH 7.4): 179.24
Polar Surface Area: 42 Å2
Polarizability: 40.4±0.5 10-24cm3
Surface Tension: 48.6±3.0 dyne/cm
Molar Volume: 304.2±3.0 cm3

Click to predict properties on the Chemicalize site


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