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ChemSpider 2D Image | 7-ethynyl-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one | C17H11FN2O

7-ethynyl-5-(2-fluorophenyl)-1,3-dihydro-1,4-benzodiazepin-2-one

  • Molecular FormulaC17H11FN2O
  • Average mass278.280 Da
  • Monoisotopic mass278.085541 Da
  • ChemSpider ID19871717

More details:






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

Density: 1.2±0.0 g/cm3
Boiling Point: 455.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 71.5±0.0 kJ/mol
Flash Point: 229.2±0.0 °C
Index of Refraction: 1.613
Molar Refractivity: 79.9±0.0 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.63
ACD/BCF (pH 5.5): 58.68
ACD/KOC (pH 5.5): 641.68
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 58.77
ACD/KOC (pH 7.4): 642.61
Polar Surface Area: 41 Å2
Polarizability: 31.7±0.0 10-24cm3
Surface Tension: 42.0±0.0 dyne/cm
Molar Volume: 229.5±0.0 cm3

Click to predict properties on the Chemicalize site






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