ChemSpider 2D Image | 1-[4-(Dimethylamino)-6-methyl-2-pyrimidinyl]-1H-1,2,4-triazole-3-carbonitrile | C10H11N7

1-[4-(Dimethylamino)-6-methyl-2-pyrimidinyl]-1H-1,2,4-triazole-3-carbonitrile

  • Molecular FormulaC10H11N7
  • Average mass229.241 Da
  • Monoisotopic mass229.107590 Da
  • ChemSpider ID30627299

More details:

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

1-[4-(Dimethylamino)-6-methyl-2-pyrimidinyl]-1H-1,2,4-triazol-3-carbonitril [German] [ACD/IUPAC Name]
1-[4-(Dimethylamino)-6-methyl-2-pyrimidinyl]-1H-1,2,4-triazole-3-carbonitrile [ACD/IUPAC Name]
1-[4-(Diméthylamino)-6-méthyl-2-pyrimidinyl]-1H-1,2,4-triazole-3-carbonitrile [French] [ACD/IUPAC Name]
1H-1,2,4-Triazole-3-carbonitrile, 1-[4-(dimethylamino)-6-methyl-2-pyrimidinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 489.7±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.6±3.0 kJ/mol
Flash Point: 249.9±26.5 °C
Index of Refraction: 1.684
Molar Refractivity: 65.0±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.10
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.72
ACD/LogD (pH 7.4): 0.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.73
Polar Surface Area: 84 Å2
Polarizability: 25.8±0.5 10-24cm3
Surface Tension: 53.4±7.0 dyne/cm
Molar Volume: 171.2±7.0 cm3

Click to predict properties on the Chemicalize site


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