Found 81 results

Search term: MF = 'C_{21}H_{18}N_{8}'
ChemSpider 2D Image | 8-{3-Isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl}quinoline | C21H18N8

8-{3-Isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl}quinoline

  • Molecular FormulaC21H18N8
  • Average mass382.421 Da
  • Monoisotopic mass382.165436 Da
  • ChemSpider ID29671568

More details:

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

1269188-95-5 [RN]
8-{3-Isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl}chinolin [German] [ACD/IUPAC Name]
8-{3-Isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl}quinoléine [French] [ACD/IUPAC Name]
8-{3-Isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl}quinoline [ACD/IUPAC Name]
Quinoline, 8-[3-(1-methylethyl)-5-[6-(4H-1,2,4-triazol-4-yl)-2-pyridinyl]-1H-1,2,4-triazol-1-yl]- [ACD/Index Name]
8-{3-isopropyl-5-[6-(4H-1,2,4-triazol-4-yl)pyridin-2-yl]-1H-1,2,4-triazol-1-yl}quinoline

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

Density: 1.4±0.1 g/cm3
Boiling Point: 693.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 372.9±34.3 °C
Index of Refraction: 1.750
Molar Refractivity: 112.4±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.79
ACD/LogD (pH 5.5): 2.45
ACD/BCF (pH 5.5): 42.62
ACD/KOC (pH 5.5): 510.21
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 42.73
ACD/KOC (pH 7.4): 511.52
Polar Surface Area: 87 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 58.4±7.0 dyne/cm
Molar Volume: 276.0±7.0 cm3

Click to predict properties on the Chemicalize site


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