ChemSpider 2D Image | 4-[3-(4-Nitro-1H-pyrazol-1-yl)propanoyl]-2-morpholinecarboxylic acid | C11H14N4O6

4-[3-(4-Nitro-1H-pyrazol-1-yl)propanoyl]-2-morpholinecarboxylic acid

  • Molecular FormulaC11H14N4O6
  • Average mass298.252 Da
  • Monoisotopic mass298.091339 Da
  • ChemSpider ID53711577

More details:

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

2-Morpholinecarboxylic acid, 4-[3-(4-nitro-1H-pyrazol-1-yl)-1-oxopropyl]- [ACD/Index Name]
4-[3-(4-Nitro-1H-pyrazol-1-yl)propanoyl]-2-morpholincarbonsäure [German] [ACD/IUPAC Name]
4-[3-(4-Nitro-1H-pyrazol-1-yl)propanoyl]-2-morpholinecarboxylic acid [ACD/IUPAC Name]
Acide 4-[3-(4-nitro-1H-pyrazol-1-yl)propanoyl]-2-morpholinecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 615.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 325.9±31.5 °C
Index of Refraction: 1.676
Molar Refractivity: 68.7±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -0.08
ACD/LogD (pH 5.5): -2.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 130 Å2
Polarizability: 27.2±0.5 10-24cm3
Surface Tension: 75.8±7.0 dyne/cm
Molar Volume: 182.7±7.0 cm3

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