Found 1 result

Search term: 136247-18-2 (Found by synonym)
ChemSpider 2D Image | 8-[4-(4-Fluorophenyl)-4-oxobutyl]-3-[2-(4-nitrophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one | C31H33FN4O4

8-[4-(4-Fluorophenyl)-4-oxobutyl]-3-[2-(4-nitrophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one

  • Molecular FormulaC31H33FN4O4
  • Average mass544.617 Da
  • Monoisotopic mass544.248596 Da
  • ChemSpider ID21896849

More details:

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

1,3,8-Triazaspiro[4.5]decan-4-one, 8-[4-(4-fluorophenyl)-4-oxobutyl]-3-[2-(4-nitrophenyl)ethyl]-1-phenyl- [ACD/Index Name]
8-[4-(4-Fluorophenyl)-4-oxobutyl]-3-[2-(4-nitrophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one [ACD/IUPAC Name]
8-[4-(4-Fluorophényl)-4-oxobutyl]-3-[2-(4-nitrophényl)éthyl]-1-phényl-1,3,8-triazaspiro[4.5]décan-4-one [French] [ACD/IUPAC Name]
8-[4-(4-Fluorphenyl)-4-oxobutyl]-3-[2-(4-nitrophenyl)ethyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-on [German] [ACD/IUPAC Name]
136247-18-2 [RN]
8-(4-(4-Fluorophenyl)-4-oxobutyl)-3-(4-nitrophenethyl)-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one
N-(p-Nitrophenethyl)spiperone

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

Density: 1.3±0.1 g/cm3
Boiling Point: 743.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.4±3.0 kJ/mol
Flash Point: 403.3±32.9 °C
Index of Refraction: 1.651
Molar Refractivity: 150.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.62
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 1.76
ACD/KOC (pH 5.5): 7.48
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 37.26
ACD/KOC (pH 7.4): 158.45
Polar Surface Area: 90 Å2
Polarizability: 59.6±0.5 10-24cm3
Surface Tension: 63.9±5.0 dyne/cm
Molar Volume: 411.5±5.0 cm3

Click to predict properties on the Chemicalize site


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