ChemSpider 2D Image | 5,5'-Diethynyl-2,2'-bipyrimidine | C12H6N4

5,5'-Diethynyl-2,2'-bipyrimidine

  • Molecular FormulaC12H6N4
  • Average mass206.203 Da
  • Monoisotopic mass206.059250 Da
  • ChemSpider ID28560558

More details:

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

2,2'-Bipyrimidine, 5,5'-diethynyl- [ACD/Index Name]
5,5'-Diethinyl-2,2'-bipyrimidin [German] [ACD/IUPAC Name]
5,5'-Diethynyl-2,2'-bipyrimidine [ACD/IUPAC Name]
5,5'-Diéthynyl-2,2'-bipyrimidine [French] [ACD/IUPAC Name]
5,5'-bis-ethynyl-2,2'-bipyrimidine
679844-18-9 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 463.3±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 224.2±21.1 °C
Index of Refraction: 1.646
Molar Refractivity: 56.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.37
ACD/LogD (pH 5.5): 0.86
ACD/BCF (pH 5.5): 2.63
ACD/KOC (pH 5.5): 69.55
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 2.63
ACD/KOC (pH 7.4): 69.55
Polar Surface Area: 52 Å2
Polarizability: 22.5±0.5 10-24cm3
Surface Tension: 85.0±5.0 dyne/cm
Molar Volume: 156.5±5.0 cm3

Click to predict properties on the Chemicalize site


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