ChemSpider 2D Image | 1-Isopropyl-2,2-dinitroaziridine | C5H9N3O4

1-Isopropyl-2,2-dinitroaziridine

  • Molecular FormulaC5H9N3O4
  • Average mass175.143 Da
  • Monoisotopic mass175.059311 Da
  • ChemSpider ID24211665

More details:

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

1-Isopropyl-2,2-dinitroaziridin [German] [ACD/IUPAC Name]
1-Isopropyl-2,2-dinitroaziridine [ACD/IUPAC Name]
1-Isopropyl-2,2-dinitroaziridine [French] [ACD/IUPAC Name]
Aziridine, 1-(1-methylethyl)-2,2-dinitro- [ACD/Index Name]
158670-15-6 [RN]
2,2-Dinitro-1-(propan-2-yl)aziridine
Aziridine, 1-(1-methylethyl)-2,2-dinitro- (9CI)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 282.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.1±3.0 kJ/mol
Flash Point: 124.4±27.3 °C
Index of Refraction: 1.536
Molar Refractivity: 39.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 0.96
ACD/BCF (pH 5.5): 3.16
ACD/KOC (pH 5.5): 79.29
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 3.16
ACD/KOC (pH 7.4): 79.29
Polar Surface Area: 95 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 53.3±5.0 dyne/cm
Molar Volume: 125.4±5.0 cm3

Click to predict properties on the Chemicalize site


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