ChemSpider 2D Image | 2-[(1,1-~2~H_2_)Ethyl](~2~H_3_)pyrazine | C6H3D5N2

2-[(1,1-2H2)Ethyl](2H3)pyrazine

  • Molecular FormulaC6H3D5N2
  • Average mass113.172 Da
  • Monoisotopic mass113.100136 Da
  • ChemSpider ID25196731
  • Non-standard isotope - Non-standard isotope


More details:






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

2-[(1,1-2H2)Ethyl](2H3)pyrazin [German] [ACD/IUPAC Name]
2-[(1,1-2H2)Ethyl](2H3)pyrazine [ACD/IUPAC Name]
2-[(1,1-2H2)Éthyl](2H3)pyrazine [French] [ACD/IUPAC Name]
Pyrazine-2,3,5-d3, 6-(ethyl-1,1-d2)- [ACD/Index Name]
1276197-45-5 [RN]
2-Ethyl-1,4-diazine
2-Ethyl-α,α-d2-pyrazine-3,5,6-d3
2-Ethyl-α,α-d2-pyrazine-3,5,6-d3

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

Density: 1.0±0.1 g/cm3
Boiling Point: 154.9±20.0 °C at 760 mmHg
Vapour Pressure: 4.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 37.5±3.0 kJ/mol
Flash Point: 42.8±0.0 °C
Index of Refraction: 1.500
Molar Refractivity: 32.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.71
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.96
ACD/KOC (pH 5.5): 56.31
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.96
ACD/KOC (pH 7.4): 56.32
Polar Surface Area: 26 Å2
Polarizability: 12.7±0.5 10-24cm3
Surface Tension: 39.3±3.0 dyne/cm
Molar Volume: 108.7±3.0 cm3

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