ChemSpider 2D Image | 1-(Cyclohexylmethyl)-N-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide | C18H28N6O

1-(Cyclohexylmethyl)-N-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC18H28N6O
  • Average mass344.454 Da
  • Monoisotopic mass344.232452 Da
  • ChemSpider ID23047499

More details:

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

1-(Cyclohexylmethyl)-N-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1-(Cyclohexylmethyl)-N-isopropyl-N-[(1-methyl-1H-imidazol-2-yl)methyl]-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-(Cyclohexylméthyl)-N-isopropyl-N-[(1-méthyl-1H-imidazol-2-yl)méthyl]-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxamide, 1-(cyclohexylmethyl)-N-(1-methylethyl)-N-[(1-methyl-1H-imidazol-2-yl)methyl]- [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: 566.7±56.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.1±3.0 kJ/mol
Flash Point: 296.5±31.8 °C
Index of Refraction: 1.632
Molar Refractivity: 99.2±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.91
ACD/KOC (pH 5.5): 29.33
ACD/LogD (pH 7.4): 1.90
ACD/BCF (pH 7.4): 16.07
ACD/KOC (pH 7.4): 246.71
Polar Surface Area: 69 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 47.5±7.0 dyne/cm
Molar Volume: 278.0±7.0 cm3

Click to predict properties on the Chemicalize site


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