ChemSpider 2D Image | 5-(Benzylamino)-2-propyl-1(2H)-isoquinolinone | C19H20N2O

5-(Benzylamino)-2-propyl-1(2H)-isoquinolinone

  • Molecular FormulaC19H20N2O
  • Average mass292.375 Da
  • Monoisotopic mass292.157562 Da
  • ChemSpider ID26948178

More details:

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

1(2H)-Isoquinolinone, 5-[(phenylmethyl)amino]-2-propyl- [ACD/Index Name]
5-(Benzylamino)-2-propyl-1(2H)-isochinolinon [German] [ACD/IUPAC Name]
5-(Benzylamino)-2-propyl-1(2H)-isoquinoléinone [French] [ACD/IUPAC Name]
5-(Benzylamino)-2-propyl-1(2H)-isoquinolinone [ACD/IUPAC Name]
5-Benzylamino-2-propylisoquinolin-1(2H)-one

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

Density: 1.2±0.1 g/cm3
Boiling Point: 495.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.3±28.7 °C
Index of Refraction: 1.633
Molar Refractivity: 89.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 3.19
ACD/BCF (pH 5.5): 156.26
ACD/KOC (pH 5.5): 1292.91
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 156.76
ACD/KOC (pH 7.4): 1297.02
Polar Surface Area: 32 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 51.2±3.0 dyne/cm
Molar Volume: 251.4±3.0 cm3

Click to predict properties on the Chemicalize site


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