ChemSpider 2D Image | 1-Isopropyl-1,2,3,4-tetrahydro-6-quinolinecarbonitrile | C13H16N2

1-Isopropyl-1,2,3,4-tetrahydro-6-quinolinecarbonitrile

  • Molecular FormulaC13H16N2
  • Average mass200.279 Da
  • Monoisotopic mass200.131348 Da
  • ChemSpider ID30660112

More details:

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

1-Isopropyl-1,2,3,4-tetrahydro-6-chinolincarbonitril [German] [ACD/IUPAC Name]
1-Isopropyl-1,2,3,4-tétrahydro-6-quinoléinecarbonitrile [French] [ACD/IUPAC Name]
1-Isopropyl-1,2,3,4-tetrahydro-6-quinolinecarbonitrile [ACD/IUPAC Name]
6-Quinolinecarbonitrile, 1,2,3,4-tetrahydro-1-(1-methylethyl)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 352.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.8±3.0 kJ/mol
Flash Point: 153.4±15.2 °C
Index of Refraction: 1.567
Molar Refractivity: 60.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 3.60
ACD/BCF (pH 5.5): 315.81
ACD/KOC (pH 5.5): 2126.00
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 323.82
ACD/KOC (pH 7.4): 2179.93
Polar Surface Area: 27 Å2
Polarizability: 24.1±0.5 10-24cm3
Surface Tension: 45.7±5.0 dyne/cm
Molar Volume: 186.4±5.0 cm3

Click to predict properties on the Chemicalize site


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