ChemSpider 2D Image | 2-{[6-(3-Thienyl)-3-isoquinolinyl]amino}ethanol | C15H14N2OS

2-{[6-(3-Thienyl)-3-isoquinolinyl]amino}ethanol

  • Molecular FormulaC15H14N2OS
  • Average mass270.349 Da
  • Monoisotopic mass270.082672 Da
  • ChemSpider ID24808374

More details:

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

2-{[6-(3-Thienyl)-3-isochinolinyl]amino}ethanol [German] [ACD/IUPAC Name]
2-{[6-(3-Thiényl)-3-isoquinoléinyl]amino}éthanol [French] [ACD/IUPAC Name]
2-{[6-(3-Thienyl)-3-isoquinolinyl]amino}ethanol [ACD/IUPAC Name]
Ethanol, 2-[[6-(3-thienyl)-3-isoquinolinyl]amino]- [ACD/Index Name]
Kinome_3506

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

Density: 1.3±0.1 g/cm3
Boiling Point: 485.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 247.3±27.3 °C
Index of Refraction: 1.720
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.96
ACD/LogD (pH 5.5): 3.30
ACD/BCF (pH 5.5): 180.93
ACD/KOC (pH 5.5): 1353.09
ACD/LogD (pH 7.4): 3.39
ACD/BCF (pH 7.4): 223.05
ACD/KOC (pH 7.4): 1668.14
Polar Surface Area: 73 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 62.8±3.0 dyne/cm
Molar Volume: 205.0±3.0 cm3

Click to predict properties on the Chemicalize site


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