ChemSpider 2D Image | {[1-(2-Hydroxyethyl)-1,2,3,4,4a,5-hexahydro-6-quinolinyl]methylene}malononitrile | C15H17N3O

{[1-(2-Hydroxyethyl)-1,2,3,4,4a,5-hexahydro-6-quinolinyl]methylene}malononitrile

  • Molecular FormulaC15H17N3O
  • Average mass255.315 Da
  • Monoisotopic mass255.137161 Da
  • ChemSpider ID26517069

More details:

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

{[1-(2-Hydroxyethyl)-1,2,3,4,4a,5-hexahydro-6-chinolinyl]methylen}malononitril [German] [ACD/IUPAC Name]
{[1-(2-Hydroxyéthyl)-1,2,3,4,4a,5-hexahydro-6-quinoléinyl]méthylène}malononitrile [French] [ACD/IUPAC Name]
{[1-(2-Hydroxyethyl)-1,2,3,4,4a,5-hexahydro-6-quinolinyl]methylene}malononitrile [ACD/IUPAC Name]
Propanedinitrile, 2-[[1,2,3,4,4a,5-hexahydro-1-(2-hydroxyethyl)-6-quinolinyl]methylene]- [ACD/Index 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: 463.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 83.6±6.0 kJ/mol
Flash Point: 234.3±28.7 °C
Index of Refraction: 1.599
Molar Refractivity: 71.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.87
ACD/LogD (pH 5.5): 0.93
ACD/BCF (pH 5.5): 2.14
ACD/KOC (pH 5.5): 40.20
ACD/LogD (pH 7.4): 1.52
ACD/BCF (pH 7.4): 8.39
ACD/KOC (pH 7.4): 157.80
Polar Surface Area: 71 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 59.6±5.0 dyne/cm
Molar Volume: 210.1±5.0 cm3

Click to predict properties on the Chemicalize site


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