ChemSpider 2D Image | 4-[3-({3-[4-(4-Fluorobenzoyl)-1-piperidinyl](~2~H_6_)propyl}oxy)-4-methoxyphenyl]-2-pyrrolidinone | C26H25D6FN2O4

4-[3-({3-[4-(4-Fluorobenzoyl)-1-piperidinyl](2H6)propyl}oxy)-4-methoxyphenyl]-2-pyrrolidinone

  • Molecular FormulaC26H25D6FN2O4
  • Average mass460.571 Da
  • Monoisotopic mass460.264435 Da
  • ChemSpider ID115006438

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Pyrrolidinone, 4-[3-[[3-[4-(4-fluorobenzoyl)-1-piperidinyl]propyl-1,1,2,2,3,3-d6]oxy]-4-methoxyphenyl]- [ACD/Index Name]
4-[3-({3-[4-(4-Fluorbenzoyl)-1-piperidinyl](2H6)propyl}oxy)-4-methoxyphenyl]-2-pyrrolidinon [German] [ACD/IUPAC Name]
4-[3-({3-[4-(4-Fluorobenzoyl)-1-piperidinyl](2H6)propyl}oxy)-4-methoxyphenyl]-2-pyrrolidinone [ACD/IUPAC Name]
4-[3-({3-[4-(4-Fluorobenzoyl)-1-pipéridinyl](2H6)propyl}oxy)-4-méthoxyphényl]-2-pyrrolidinone [French] [ACD/IUPAC 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: 658.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.9±3.0 kJ/mol
Flash Point: 352.1±31.5 °C
Index of Refraction: 1.560
Molar Refractivity: 123.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.31
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.82
ACD/LogD (pH 7.4): 1.85
ACD/BCF (pH 7.4): 8.49
ACD/KOC (pH 7.4): 82.17
Polar Surface Area: 68 Å2
Polarizability: 48.9±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 381.2±3.0 cm3

Click to predict properties on the Chemicalize site


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