ChemSpider 2D Image | 4-Isoquinolinyl(3-phenoxyphenyl)methanone | C22H15NO2

4-Isoquinolinyl(3-phenoxyphenyl)methanone

  • Molecular FormulaC22H15NO2
  • Average mass325.360 Da
  • Monoisotopic mass325.110291 Da
  • ChemSpider ID27525415

More details:

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

1187171-72-7 [RN]
4-Isochinolinyl(3-phenoxyphenyl)methanon [German] [ACD/IUPAC Name]
4-Isoquinoléinyl(3-phénoxyphényl)méthanone [French] [ACD/IUPAC Name]
4-Isoquinolinyl(3-phenoxyphenyl)methanone [ACD/IUPAC Name]
Isoquinolin-4-yl(3-phenoxyphenyl)methanone
Methanone, 4-isoquinolinyl(3-phenoxyphenyl)- [ACD/Index Name]
4-(3-Phenoxybenzoyl)isoquinoline
isoquinolin-4-yl-(3-phenoxyphenyl)methanone
MFCD13153032 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 525.7±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±3.0 kJ/mol
Flash Point: 271.7±24.6 °C
Index of Refraction: 1.664
Molar Refractivity: 98.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2131.94
ACD/KOC (pH 5.5): 8395.27
ACD/LogD (pH 7.4): 4.68
ACD/BCF (pH 7.4): 2137.04
ACD/KOC (pH 7.4): 8415.35
Polar Surface Area: 39 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 52.9±3.0 dyne/cm
Molar Volume: 265.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement