ChemSpider 2D Image | 2-(1H-Benzimidazol-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-one | C16H12N4O

2-(1H-Benzimidazol-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-one

  • Molecular FormulaC16H12N4O
  • Average mass276.293 Da
  • Monoisotopic mass276.101105 Da
  • ChemSpider ID30829603

More details:






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

2-(1H-Benzimidazol-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-on [German] [ACD/IUPAC Name]
2-(1H-Benzimidazol-1-ylmethyl)-4H-pyrido[1,2-a]pyrimidin-4-one [ACD/IUPAC Name]
2-(1H-Benzimidazol-1-ylméthyl)-4H-pyrido[1,2-a]pyrimidin-4-one [French] [ACD/IUPAC Name]
4H-Pyrido[1,2-a]pyrimidin-4-one, 2-(1H-benzimidazol-1-ylmethyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 496.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 254.0±31.5 °C
Index of Refraction: 1.723
Molar Refractivity: 81.0±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 8.24
ACD/KOC (pH 5.5): 137.75
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 13.08
ACD/KOC (pH 7.4): 218.77
Polar Surface Area: 50 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 58.9±7.0 dyne/cm
Molar Volume: 204.4±7.0 cm3

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