ChemSpider 2D Image | (3R)-3-(5-Cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine | C13H22N4

(3R)-3-(5-Cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine

  • Molecular FormulaC13H22N4
  • Average mass234.341 Da
  • Monoisotopic mass234.184448 Da
  • ChemSpider ID50663379

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-(5-Cyclohexyl-1H-1,2,4-triazol-3-yl)piperidin [German] [ACD/IUPAC Name]
(3R)-3-(5-Cyclohexyl-1H-1,2,4-triazol-3-yl)piperidine [ACD/IUPAC Name]
(3R)-3-(5-Cyclohexyl-1H-1,2,4-triazol-3-yl)pipéridine [French] [ACD/IUPAC Name]
Piperidine, 3-(5-cyclohexyl-1H-1,2,4-triazol-3-yl)-, (3R)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 439.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.7±3.0 kJ/mol
Flash Point: 219.7±31.5 °C
Index of Refraction: 1.546
Molar Refractivity: 67.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): -0.74
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.57
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 8.47
Polar Surface Area: 54 Å2
Polarizability: 26.7±0.5 10-24cm3
Surface Tension: 48.3±3.0 dyne/cm
Molar Volume: 212.6±3.0 cm3

Click to predict properties on the Chemicalize site


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