ChemSpider 2D Image | 4-(1H-Perimidin-2-yl)benzoate | C18H11N2O2

4-(1H-Perimidin-2-yl)benzoate

  • Molecular FormulaC18H11N2O2
  • Average mass287.293 Da
  • Monoisotopic mass287.082611 Da
  • ChemSpider ID95737498

  • Charge - Charge

More details:

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

4-(1H-Perimidin-2-yl)benzoat [German] [ACD/IUPAC Name]
4-(1H-Perimidin-2-yl)benzoate [ACD/IUPAC Name]
4-(1H-Périmidin-2-yl)benzoate [French] [ACD/IUPAC Name]
Benzoic acid, 4-(1H-perimidin-2-yl)-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 570.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.0±3.0 kJ/mol
Flash Point: 298.8±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 1.42
ACD/BCF (pH 5.5): 1.84
ACD/KOC (pH 5.5): 11.01
ACD/LogD (pH 7.4): 1.09
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.20
Polar Surface Area: 65 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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