ChemSpider 2D Image | {3-(3-Chlorobenzyl)-1-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-3-piperidinyl}methanol | C21H23ClFN3O

{3-(3-Chlorobenzyl)-1-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-3-piperidinyl}methanol

  • Molecular FormulaC21H23ClFN3O
  • Average mass387.878 Da
  • Monoisotopic mass387.151367 Da
  • ChemSpider ID22209521

More details:

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

{3-(3-Chlorbenzyl)-1-[(5-fluor-1H-benzimidazol-2-yl)methyl]-3-piperidinyl}methanol [German] [ACD/IUPAC Name]
{3-(3-Chlorobenzyl)-1-[(5-fluoro-1H-benzimidazol-2-yl)methyl]-3-piperidinyl}methanol [ACD/IUPAC Name]
{3-(3-Chlorobenzyl)-1-[(5-fluoro-1H-benzimidazol-2-yl)méthyl]-3-pipéridinyl}méthanol [French] [ACD/IUPAC Name]
3-Piperidinemethanol, 3-[(3-chlorophenyl)methyl]-1-[(6-fluoro-1H-benzimidazol-2-yl)methyl]- [ACD/Index Name]
{3-(3-chlorobenzyl)-1-[(6-fluoro-1H-benzimidazol-2-yl)methyl]-3-piperidinyl}methanol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 564.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.2±3.0 kJ/mol
Flash Point: 295.0±27.3 °C
Index of Refraction: 1.646
Molar Refractivity: 106.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 1.87
ACD/KOC (pH 5.5): 13.02
ACD/LogD (pH 7.4): 3.03
ACD/BCF (pH 7.4): 88.74
ACD/KOC (pH 7.4): 618.72
Polar Surface Area: 52 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 59.7±3.0 dyne/cm
Molar Volume: 292.9±3.0 cm3

Click to predict properties on the Chemicalize site


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