ChemSpider 2D Image | 1-[1-Hexyl-4-(3-hydroxyphenyl)-4-piperidinyl]-1-propanone | C20H31NO2

1-[1-Hexyl-4-(3-hydroxyphenyl)-4-piperidinyl]-1-propanone

  • Molecular FormulaC20H31NO2
  • Average mass317.466 Da
  • Monoisotopic mass317.235474 Da
  • ChemSpider ID23181749

More details:

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

1-[1-Hexyl-4-(3-hydroxyphenyl)-4-piperidinyl]-1-propanon [German] [ACD/IUPAC Name]
1-[1-Hexyl-4-(3-hydroxyphenyl)-4-piperidinyl]-1-propanone [ACD/IUPAC Name]
1-[1-Hexyl-4-(3-hydroxyphényl)-4-pipéridinyl]-1-propanone [French] [ACD/IUPAC Name]
1-[1-hexyl-4-(3-hydroxyphenyl)piperidin-4-yl]propan-1-one
1-Propanone, 1-[1-hexyl-4-(3-hydroxyphenyl)-4-piperidinyl]- [ACD/Index Name]
1-[1-Hexyl-4-(3-hydroxy-phenyl)-piperidin-4-yl]-propan-1-one
55078-68-7 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL440699/

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

Density: 1.0±0.1 g/cm3
Boiling Point: 455.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.3±3.0 kJ/mol
Flash Point: 229.3±28.7 °C
Index of Refraction: 1.522
Molar Refractivity: 94.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 1.36
ACD/KOC (pH 5.5): 7.85
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 64.78
ACD/KOC (pH 7.4): 372.70
Polar Surface Area: 41 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 309.9±3.0 cm3

Click to predict properties on the Chemicalize site


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