ChemSpider 2D Image | 4-[(E)-2-Phenylvinyl][1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carbonitrile | C13H8N6

4-[(E)-2-Phenylvinyl][1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carbonitrile

  • Molecular FormulaC13H8N6
  • Average mass248.243 Da
  • Monoisotopic mass248.081039 Da
  • ChemSpider ID28614066

  • Double-bond stereo - Double-bond stereo

More details:

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

[1,2,4]Triazolo[5,1-c][1,2,4]triazine-3-carbonitrile, 4-[(E)-2-phenylethenyl]- [ACD/Index Name]
4-[(E)-2-Phenylvinyl][1,2,4]triazolo[5,1-c][1,2,4]triazin-3-carbonitril [German] [ACD/IUPAC Name]
4-[(E)-2-Phenylvinyl][1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carbonitrile [ACD/IUPAC Name]
4-[(E)-2-Phénylvinyl][1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carbonitrile [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.729
Molar Refractivity: 72.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.22
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 43.07
ACD/KOC (pH 5.5): 514.49
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 43.07
ACD/KOC (pH 7.4): 514.49
Polar Surface Area: 80 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 61.6±7.0 dyne/cm
Molar Volume: 182.8±7.0 cm3

Click to predict properties on the Chemicalize site


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