ChemSpider 2D Image | 4-Fluoro-N-(1,2,3,4-tetrahydro-7-isoquinolinyl)benzamide | C16H15FN2O

4-Fluoro-N-(1,2,3,4-tetrahydro-7-isoquinolinyl)benzamide

  • Molecular FormulaC16H15FN2O
  • Average mass270.302 Da
  • Monoisotopic mass270.116852 Da
  • ChemSpider ID35034251

More details:






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

4-Fluor-N-(1,2,3,4-tetrahydro-7-isochinolinyl)benzamid [German] [ACD/IUPAC Name]
4-Fluoro-N-(1,2,3,4-tétrahydro-7-isoquinoléinyl)benzamide [French] [ACD/IUPAC Name]
4-Fluoro-N-(1,2,3,4-tetrahydro-7-isoquinolinyl)benzamide [ACD/IUPAC Name]
Benzamide, 4-fluoro-N-(1,2,3,4-tetrahydro-7-isoquinolinyl)- [ACD/Index Name]
4-Fluoro-N-(1,2,3,4-Tetrahydroisoquinolin-7-Yl)benzamide
QBB

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 352.8±42.0 °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: 167.2±27.9 °C
Index of Refraction: 1.627
Molar Refractivity: 76.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.03
ACD/LogD (pH 5.5): -0.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.10
Polar Surface Area: 41 Å2
Polarizability: 30.3±0.5 10-24cm3
Surface Tension: 50.1±3.0 dyne/cm
Molar Volume: 215.4±3.0 cm3

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