ChemSpider 2D Image | 1-{3-[2-(2,4-Difluorophenyl)ethyl]-1-piperidinyl}-2-(2-hydroxyphenyl)ethanone | C21H23F2NO2

1-{3-[2-(2,4-Difluorophenyl)ethyl]-1-piperidinyl}-2-(2-hydroxyphenyl)ethanone

  • Molecular FormulaC21H23F2NO2
  • Average mass359.410 Da
  • Monoisotopic mass359.169678 Da
  • ChemSpider ID29557492

More details:

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

1-{3-[2-(2,4-Difluorophenyl)ethyl]-1-piperidinyl}-2-(2-hydroxyphenyl)ethanone [ACD/IUPAC Name]
1-{3-[2-(2,4-Difluorophényl)éthyl]-1-pipéridinyl}-2-(2-hydroxyphényl)éthanone [French] [ACD/IUPAC Name]
1-{3-[2-(2,4-Difluorphenyl)ethyl]-1-piperidinyl}-2-(2-hydroxyphenyl)ethanon [German] [ACD/IUPAC Name]
Ethanone, 1-[3-[2-(2,4-difluorophenyl)ethyl]-1-piperidinyl]-2-(2-hydroxyphenyl)- [ACD/Index Name]
2-(2-{3-[2-(2,4-difluorophenyl)ethyl]-1-piperidinyl}-2-oxoethyl)phenol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 521.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.4±3.0 kJ/mol
Flash Point: 269.0±28.7 °C
Index of Refraction: 1.565
Molar Refractivity: 96.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.32
ACD/LogD (pH 5.5): 4.20
ACD/BCF (pH 5.5): 911.89
ACD/KOC (pH 5.5): 4574.26
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 909.29
ACD/KOC (pH 7.4): 4561.23
Polar Surface Area: 41 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 46.2±3.0 dyne/cm
Molar Volume: 294.6±3.0 cm3

Click to predict properties on the Chemicalize site


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