ChemSpider 2D Image | 1-Phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxylic acid | C14H10N4O2

1-Phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxylic acid

  • Molecular FormulaC14H10N4O2
  • Average mass266.255 Da
  • Monoisotopic mass266.080383 Da
  • ChemSpider ID23363036

More details:

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

1H-1,2,3-Triazole-4-carboxylic acid, 1-phenyl-5-(4-pyridinyl)- [ACD/Index Name]
1-Phenyl-5-(4-pyridinyl)-1H-1,2,3-triazol-4-carbonsäure [German] [ACD/IUPAC Name]
1-Phenyl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxylic acid [ACD/IUPAC Name]
1-phenyl-5-(pyridin-4-yl)-1H-1,2,3-triazole-4-carboxylic acid
Acide 1-phényl-5-(4-pyridinyl)-1H-1,2,3-triazole-4-carboxylique [French] [ACD/IUPAC Name]
1017415-16-5 [RN]
1-phenyl-5-(4-pyridyl)-1H-1,2,3-triazole-4-carboxylic acid
1-Phenyl-5-pyridin-4-yl-1H-[1,2,3]triazole-4-carboxylic acid
1-phenyl-5-pyridin-4-yl-1H-1,2,3-triazole-4-carboxylic acid
BS-3609
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 501.4±58.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.1±3.0 kJ/mol
Flash Point: 257.0±32.3 °C
Index of Refraction: 1.701
Molar Refractivity: 74.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.19
ACD/LogD (pH 5.5): -0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.15
ACD/LogD (pH 7.4): -1.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 60.4±7.0 dyne/cm
Molar Volume: 192.0±7.0 cm3

Click to predict properties on the Chemicalize site


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