ChemSpider 2D Image | 3-Methyl-1,2,4,5-tetroxane | C3H6O4

3-Methyl-1,2,4,5-tetroxane

  • Molecular FormulaC3H6O4
  • Average mass106.077 Da
  • Monoisotopic mass106.026611 Da
  • ChemSpider ID67163618

More details:






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

1,2,4,5-Tetroxane, 3-methyl- [ACD/Index Name]
3-Methyl-1,2,4,5-tetroxan [German] [ACD/IUPAC Name]
3-Methyl-1,2,4,5-tetroxane [ACD/IUPAC Name]
3-Méthyl-1,2,4,5-tétroxane [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 51.0±20.0 °C at 760 mmHg
Vapour Pressure: 294.5±0.1 mmHg at 25°C
Enthalpy of Vaporization: 28.2±3.0 kJ/mol
Flash Point: -22.9±21.7 °C
Index of Refraction: 1.367
Molar Refractivity: 20.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.04
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 20.04
Polar Surface Area: 37 Å2
Polarizability: 8.1±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 90.6±3.0 cm3

Click to predict properties on the Chemicalize site






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