ChemSpider 2D Image | 3-(1-Methyl-4-nitro-1H-pyrazol-5-yl)serine | C7H10N4O5

3-(1-Methyl-4-nitro-1H-pyrazol-5-yl)serine

  • Molecular FormulaC7H10N4O5
  • Average mass230.178 Da
  • Monoisotopic mass230.065125 Da
  • ChemSpider ID65693776

More details:

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

1H-Pyrazole-5-propanoic acid, α-amino-β-hydroxy-1-methyl-4-nitro- [ACD/Index Name]
3-(1-Methyl-4-nitro-1H-pyrazol-5-yl)serin [German] [ACD/IUPAC Name]
3-(1-Methyl-4-nitro-1H-pyrazol-5-yl)serine [ACD/IUPAC Name]
3-(1-Méthyl-4-nitro-1H-pyrazol-5-yl)sérine [French] [ACD/IUPAC Name]
2228129-50-6 [RN]
2-amino-3-hydroxy-3-(1-methyl-4-nitro-1H-pyrazol-5-yl)propanoic acid

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

Density: 1.8±0.1 g/cm3
Boiling Point: 573.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.5±3.0 kJ/mol
Flash Point: 300.9±30.1 °C
Index of Refraction: 1.713
Molar Refractivity: 49.2±0.5 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.39
ACD/LogD (pH 5.5): -3.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 147 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 89.4±7.0 dyne/cm
Molar Volume: 125.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement