ChemSpider 2D Image | 1-({[1-(2-Hydroxyethyl)-2-piperidinyl]methyl}amino)-3-(4-nitro-1H-pyrazol-1-yl)-2-propanol | C14H25N5O4

1-({[1-(2-Hydroxyethyl)-2-piperidinyl]methyl}amino)-3-(4-nitro-1H-pyrazol-1-yl)-2-propanol

  • Molecular FormulaC14H25N5O4
  • Average mass327.379 Da
  • Monoisotopic mass327.190643 Da
  • ChemSpider ID77438896

More details:

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

1-({[1-(2-Hydroxyethyl)-2-piperidinyl]methyl}amino)-3-(4-nitro-1H-pyrazol-1-yl)-2-propanol [German] [ACD/IUPAC Name]
1-({[1-(2-Hydroxyethyl)-2-piperidinyl]methyl}amino)-3-(4-nitro-1H-pyrazol-1-yl)-2-propanol [ACD/IUPAC Name]
1-({[1-(2-Hydroxyéthyl)-2-pipéridinyl]méthyl}amino)-3-(4-nitro-1H-pyrazol-1-yl)-2-propanol [French] [ACD/IUPAC Name]
1-Piperidineethanol, 2-[[[2-hydroxy-3-(4-nitro-1H-pyrazol-1-yl)propyl]amino]methyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 549.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.3±3.0 kJ/mol
Flash Point: 286.3±30.1 °C
Index of Refraction: 1.638
Molar Refractivity: 83.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): -3.78
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 119 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 61.7±7.0 dyne/cm
Molar Volume: 231.9±7.0 cm3

Click to predict properties on the Chemicalize site


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