ChemSpider 2D Image | {4-[8-Fluoro-9-(2-naphthyl)-2-oxopyrazino[2,3-c]quinolin-1(2H)-yl]-1-piperidinyl}acetonitrile | C28H22FN5O

{4-[8-Fluoro-9-(2-naphthyl)-2-oxopyrazino[2,3-c]quinolin-1(2H)-yl]-1-piperidinyl}acetonitrile

  • Molecular FormulaC28H22FN5O
  • Average mass463.506 Da
  • Monoisotopic mass463.180847 Da
  • ChemSpider ID76739347

More details:

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

{4-[8-Fluor-9-(2-naphthyl)-2-oxopyrazino[2,3-c]chinolin-1(2H)-yl]-1-piperidinyl}acetonitril [German] [ACD/IUPAC Name]
{4-[8-Fluoro-9-(2-naphthyl)-2-oxopyrazino[2,3-c]quinolin-1(2H)-yl]-1-piperidinyl}acetonitrile [ACD/IUPAC Name]
{4-[8-Fluoro-9-(2-naphtyl)-2-oxopyrazino[2,3-c]quinoléin-1(2H)-yl]-1-pipéridinyl}acétonitrile [French] [ACD/IUPAC Name]
1-Piperidineacetonitrile, 4-[8-fluoro-9-(2-naphthalenyl)-2-oxopyrazino[2,3-c]quinolin-1(2H)-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 687.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.7±3.0 kJ/mol
Flash Point: 369.3±34.3 °C
Index of Refraction: 1.712
Molar Refractivity: 133.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.39
ACD/LogD (pH 5.5): 4.13
ACD/BCF (pH 5.5): 779.36
ACD/KOC (pH 5.5): 3928.13
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 895.11
ACD/KOC (pH 7.4): 4511.54
Polar Surface Area: 73 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 55.6±7.0 dyne/cm
Molar Volume: 339.7±7.0 cm3

Click to predict properties on the Chemicalize site


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