ChemSpider 2D Image | (5Z)-3-Amino-2-anilino-5-(4-fluorobenzylidene)-3,5-dihydro-4H-imidazol-4-one | C16H13FN4O

(5Z)-3-Amino-2-anilino-5-(4-fluorobenzylidene)-3,5-dihydro-4H-imidazol-4-one

  • Molecular FormulaC16H13FN4O
  • Average mass296.299 Da
  • Monoisotopic mass296.107330 Da
  • ChemSpider ID21178968
  • Double-bond stereo - Double-bond stereo


More details:






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

(5Z)-3-Amino-2-anilino-5-(4-fluorbenzyliden)-3,5-dihydro-4H-imidazol-4-on [German] [ACD/IUPAC Name]
(5Z)-3-Amino-2-anilino-5-(4-fluorobenzylidene)-3,5-dihydro-4H-imidazol-4-one [ACD/IUPAC Name]
(5Z)-3-Amino-2-anilino-5-(4-fluorobenzylidène)-3,5-dihydro-4H-imidazol-4-one [French] [ACD/IUPAC Name]
4H-Imidazol-4-one, 3-amino-5-[(4-fluorophenyl)methylene]-3,5-dihydro-2-(phenylamino)-, (5Z)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 451.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 226.9±31.5 °C
Index of Refraction: 1.654
Molar Refractivity: 81.3±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.26
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 36.42
ACD/KOC (pH 5.5): 456.23
ACD/LogD (pH 7.4): 2.36
ACD/BCF (pH 7.4): 36.42
ACD/KOC (pH 7.4): 456.23
Polar Surface Area: 71 Å2
Polarizability: 32.2±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 221.8±7.0 cm3

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