ChemSpider 2D Image | 2-Benzyl-7-(4-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine | C18H13ClN4

2-Benzyl-7-(4-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine

  • Molecular FormulaC18H13ClN4
  • Average mass320.776 Da
  • Monoisotopic mass320.082886 Da
  • ChemSpider ID28626499

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidine, 7-(4-chlorophenyl)-2-(phenylmethyl)- [ACD/Index Name]
2-Benzyl-7-(4-chlorophenyl)[1,2,4]triazolo[1,5-a]pyrimidine [ACD/IUPAC Name]
2-Benzyl-7-(4-chlorophényl)[1,2,4]triazolo[1,5-a]pyrimidine [French] [ACD/IUPAC Name]
2-Benzyl-7-(4-chlorphenyl)[1,2,4]triazolo[1,5-a]pyrimidin [German] [ACD/IUPAC Name]
2-Benzyl-7-(4-chloro-phenyl)-[1,2,4]triazolo[1,5-a]pyrimidine

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.693
Molar Refractivity: 93.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.78
ACD/LogD (pH 5.5): 4.14
ACD/BCF (pH 5.5): 826.46
ACD/KOC (pH 5.5): 4263.31
ACD/LogD (pH 7.4): 4.14
ACD/BCF (pH 7.4): 826.48
ACD/KOC (pH 7.4): 4263.40
Polar Surface Area: 43 Å2
Polarizability: 36.9±0.5 10-24cm3
Surface Tension: 52.4±7.0 dyne/cm
Molar Volume: 242.5±7.0 cm3

Click to predict properties on the Chemicalize site


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