ChemSpider 2D Image | 3-Ethynyl-3-oxetanol | C5H6O2

3-Ethynyl-3-oxetanol

  • Molecular FormulaC5H6O2
  • Average mass98.100 Da
  • Monoisotopic mass98.036781 Da
  • ChemSpider ID27475255

More details:






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

3-Ethinyl-3-oxetanol [German] [ACD/IUPAC Name]
3-Ethynyl-3-oxetanol [ACD/IUPAC Name]
3-Éthynyl-3-oxétanol [French] [ACD/IUPAC Name]
3-Ethynyloxetan-3-ol
3-Oxetanol, 3-ethynyl- [ACD/Index Name]
MFCD20444449 [MDL number]
[1352492-38-6]
1352492-38-6 [RN]
3-Ethynyl-3-hydroxyoxetane
3-Ethynyl-oxetan-3-ol
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 170.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.5±0.7 mmHg at 25°C
Enthalpy of Vaporization: 47.4±6.0 kJ/mol
Flash Point: 76.6±21.6 °C
Index of Refraction: 1.506
Molar Refractivity: 24.2±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.30
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.01
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.01
Polar Surface Area: 29 Å2
Polarizability: 9.6±0.5 10-24cm3
Surface Tension: 47.1±5.0 dyne/cm
Molar Volume: 81.6±5.0 cm3

Click to predict properties on the Chemicalize site






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