ChemSpider 2D Image | 2-Methyl-3,3-dinitrooxetane | C4H6N2O5

2-Methyl-3,3-dinitrooxetane

  • Molecular FormulaC4H6N2O5
  • Average mass162.101 Da
  • Monoisotopic mass162.027664 Da
  • ChemSpider ID30801214

More details:

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

2-Methyl-3,3-dinitrooxetan [German] [ACD/IUPAC Name]
2-Methyl-3,3-dinitrooxetane [ACD/IUPAC Name]
2-Méthyl-3,3-dinitrooxétane [French] [ACD/IUPAC Name]
Oxetane, 2-methyl-3,3-dinitro- [ACD/Index Name]
1824110-02-2 [RN]
3,3-Bis-nitromethyl-oxetane
6125-20-8 [RN]
MFCD22415505

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

Density: 1.5±0.1 g/cm3
Boiling Point: 312.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.4±3.0 kJ/mol
Flash Point: 176.2±29.9 °C
Index of Refraction: 1.507
Molar Refractivity: 32.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.11
ACD/LogD (pH 5.5): 0.89
ACD/BCF (pH 5.5): 2.80
ACD/KOC (pH 5.5): 72.80
ACD/LogD (pH 7.4): 0.89
ACD/BCF (pH 7.4): 2.80
ACD/KOC (pH 7.4): 72.80
Polar Surface Area: 101 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 52.8±5.0 dyne/cm
Molar Volume: 108.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement