ChemSpider 2D Image | 6-(Carboxyethynyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid | C9H4N4O4

6-(Carboxyethynyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid

  • Molecular FormulaC9H4N4O4
  • Average mass232.152 Da
  • Monoisotopic mass232.023254 Da
  • ChemSpider ID83882778

More details:

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

[1,2,4]Triazolo[1,5-a]pyrimidine-2-carboxylic acid, 6-(2-carboxyethynyl)- [ACD/Index Name]
6-(Carboxyethinyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-carbonsäure [German] [ACD/IUPAC Name]
6-(Carboxyethynyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid [ACD/IUPAC Name]
Acide 6-(carboxyéthynyl)[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.761
Molar Refractivity: 55.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.55
ACD/LogD (pH 5.5): -4.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.85
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 84.7±7.0 dyne/cm
Molar Volume: 134.6±7.0 cm3

Click to predict properties on the Chemicalize site


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