ChemSpider 2D Image | (1R,3S,4r)-2-Oxabicyclo[1.1.0]butan-4-ol | C3H4O2

(1R,3S,4r)-2-Oxabicyclo[1.1.0]butan-4-ol

  • Molecular FormulaC3H4O2
  • Average mass72.063 Da
  • Monoisotopic mass72.021126 Da
  • ChemSpider ID61715110

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1R,3S,4r)-2-Oxabicyclo[1.1.0]butan-4-ol [German] [ACD/IUPAC Name]
(1R,3S,4r)-2-Oxabicyclo[1.1.0]butan-4-ol [ACD/IUPAC Name]
(1R,3S,4r)-2-Oxabicyclo[1.1.0]butan-4-ol [French] [ACD/IUPAC Name]
2-Oxabicyclo[1.1.0]butan-4-ol, (1R,3S)- [ACD/Index Name]
1,2-Ethanediol [ACD/Index Name]
EDO

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

Density: 1.8±0.1 g/cm3
Boiling Point: 220.3±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 53.1±6.0 kJ/mol
Flash Point: 132.8±12.7 °C
Index of Refraction: 1.677
Molar Refractivity: 15.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.93
ACD/LogD (pH 5.5): -1.39
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.16
ACD/LogD (pH 7.4): -1.39
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.16
Polar Surface Area: 33 Å2
Polarizability: 6.0±0.5 10-24cm3
Surface Tension: 81.3±3.0 dyne/cm
Molar Volume: 40.0±3.0 cm3

Click to predict properties on the Chemicalize site


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