ChemSpider 2D Image | 1-[(3R,4R)-5-Hydroxy-4-methyltetrahydro-3-furanyl]ethanone | C7H12O3

1-[(3R,4R)-5-Hydroxy-4-methyltetrahydro-3-furanyl]ethanone

  • Molecular FormulaC7H12O3
  • Average mass144.168 Da
  • Monoisotopic mass144.078644 Da
  • ChemSpider ID29783573
  • defined stereocentres - 2 of 3 defined stereocentres


More details:






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

1-[(3R,4R)-5-Hydroxy-4-methyltetrahydro-3-furanyl]ethanon [German] [ACD/IUPAC Name]
1-[(3R,4R)-5-Hydroxy-4-methyltetrahydro-3-furanyl]ethanone [ACD/IUPAC Name]
1-[(3R,4R)-5-Hydroxy-4-méthyltétrahydro-3-furanyl]éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[(3R,4R)-tetrahydro-5-hydroxy-4-methyl-3-furanyl]- [ACD/Index Name]
1-((3R,4R)-5-hydroxy-4-methyltetrahydrofuran-3-yl)ethanone
188300-71-2 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 249.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 56.5±6.0 kJ/mol
Flash Point: 101.4±20.8 °C
Index of Refraction: 1.468
Molar Refractivity: 35.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.77
ACD/LogD (pH 5.5): -0.51
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 12.54
ACD/LogD (pH 7.4): -0.51
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.54
Polar Surface Area: 47 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 37.7±3.0 dyne/cm
Molar Volume: 128.0±3.0 cm3

Click to predict properties on the Chemicalize site






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