ChemSpider 2D Image | 1-(2S)-2-Oxiranylethanone | C4H6O2

1-(2S)-2-Oxiranylethanone

  • Molecular FormulaC4H6O2
  • Average mass86.089 Da
  • Monoisotopic mass86.036781 Da
  • ChemSpider ID61502710

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-(2S)-2-Oxiranylethanone
1-[(2S)-2-Oxiranyl]ethanon [German] [ACD/IUPAC Name]
1-[(2S)-2-Oxiranyl]ethanone [ACD/IUPAC Name]
1-[(2S)-2-Oxiranyl]éthanone [French] [ACD/IUPAC Name]
160798-42-5 [RN]
Ethanone, 1-[(2S)-oxiranyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 126.7±33.0 °C at 760 mmHg
Vapour Pressure: 11.5±0.2 mmHg at 25°C
Enthalpy of Vaporization: 36.5±3.0 kJ/mol
Flash Point: 36.0±18.9 °C
Index of Refraction: 1.443
Molar Refractivity: 20.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.94
ACD/LogD (pH 5.5): -0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.30
ACD/LogD (pH 7.4): -0.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.30
Polar Surface Area: 30 Å2
Polarizability: 7.9±0.5 10-24cm3
Surface Tension: 35.2±3.0 dyne/cm
Molar Volume: 75.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement