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Search term: DATA_SOURCE in ('Jan Davies')
ChemSpider 2D Image | 1-(4-isopropyl phenyl)-4-(2-pyridyl)-1,2,3-triazole | C16H16N4

1-(4-isopropyl phenyl)-4-(2-pyridyl)-1,2,3-triazole

  • Molecular FormulaC16H16N4
  • Average mass264.325 Da
  • Monoisotopic mass264.137512 Da
  • ChemSpider ID24593844

More details:

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

1-(4-isopropyl phenyl)-4-(2-pyridyl)-1,2,3-triazole
2-[1-(4-Isopropylphenyl)-1H-1,2,3-triazol-4-yl]pyridin [German] [ACD/IUPAC Name]
2-[1-(4-Isopropylphenyl)-1H-1,2,3-triazol-4-yl]pyridine [ACD/IUPAC Name]
2-[1-(4-Isopropylphényl)-1H-1,2,3-triazol-4-yl]pyridine [French] [ACD/IUPAC Name]
Pyridine, 2-[1-[4-(1-methylethyl)phenyl]-1H-1,2,3-triazol-4-yl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 439.3±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.6±3.0 kJ/mol
Flash Point: 219.5±29.3 °C
Index of Refraction: 1.633
Molar Refractivity: 81.4±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.55
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 277.77
ACD/KOC (pH 5.5): 1953.42
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 277.77
ACD/KOC (pH 7.4): 1953.45
Polar Surface Area: 44 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 43.8±7.0 dyne/cm
Molar Volume: 227.8±7.0 cm3

Click to predict properties on the Chemicalize site


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