ChemSpider 2D Image | 1-Methoxy-2-nitroacetylene | C3H3NO3

1-Methoxy-2-nitroacetylene

  • Molecular FormulaC3H3NO3
  • Average mass101.061 Da
  • Monoisotopic mass101.011292 Da
  • ChemSpider ID74142284

More details:

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

1-Methoxy-2-nitroacetylen [German] [ACD/IUPAC Name]
1-Methoxy-2-nitroacetylene [ACD/IUPAC Name]
1-Méthoxy-2-nitroacétylène [French] [ACD/IUPAC Name]
Ethyne, 1-methoxy-2-nitro- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 142.5±23.0 °C at 760 mmHg
Vapour Pressure: 7.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 36.4±3.0 kJ/mol
Flash Point: 75.4±24.6 °C
Index of Refraction: 1.452
Molar Refractivity: 21.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): 1.21
ACD/BCF (pH 5.5): 4.92
ACD/KOC (pH 5.5): 108.86
ACD/LogD (pH 7.4): 1.21
ACD/BCF (pH 7.4): 4.92
ACD/KOC (pH 7.4): 108.86
Polar Surface Area: 55 Å2
Polarizability: 8.6±0.5 10-24cm3
Surface Tension: 44.5±3.0 dyne/cm
Molar Volume: 80.5±3.0 cm3

Click to predict properties on the Chemicalize site


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