ChemSpider 2D Image | 5-Bromo-2-[(1-cyclopropyl-1H-imidazol-2-yl)sulfanyl]pyrimidine | C10H9BrN4S

5-Bromo-2-[(1-cyclopropyl-1H-imidazol-2-yl)sulfanyl]pyrimidine

  • Molecular FormulaC10H9BrN4S
  • Average mass297.174 Da
  • Monoisotopic mass295.973114 Da
  • ChemSpider ID29824529

More details:






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

5-Brom-2-[(1-cyclopropyl-1H-imidazol-2-yl)sulfanyl]pyrimidin [German] [ACD/IUPAC Name]
5-Bromo-2-[(1-cyclopropyl-1H-imidazol-2-yl)sulfanyl]pyrimidine [ACD/IUPAC Name]
5-Bromo-2-[(1-cyclopropyl-1H-imidazol-2-yl)sulfanyl]pyrimidine [French] [ACD/IUPAC Name]
Pyrimidine, 5-bromo-2-[(1-cyclopropyl-1H-imidazol-2-yl)thio]- [ACD/Index Name]
5-BROMO-2-[(1-CYCLOPROPYLIMIDAZOL-2-YL)SULFANYL]PYRIMIDINE

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

Density: 1.9±0.1 g/cm3
Boiling Point: 518.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.1±3.0 kJ/mol
Flash Point: 267.5±27.9 °C
Index of Refraction: 1.817
Molar Refractivity: 69.5±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.69
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 13.88
ACD/KOC (pH 5.5): 228.41
ACD/LogD (pH 7.4): 1.81
ACD/BCF (pH 7.4): 13.95
ACD/KOC (pH 7.4): 229.54
Polar Surface Area: 69 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 69.7±7.0 dyne/cm
Molar Volume: 160.1±7.0 cm3

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