ChemSpider 2D Image | (2S,3S,4S)-4-Acetyl-3,4-dimethyl-5-oxotetrahydro-2-furanyl acetate | C10H14O5

(2S,3S,4S)-4-Acetyl-3,4-dimethyl-5-oxotetrahydro-2-furanyl acetate

  • Molecular FormulaC10H14O5
  • Average mass214.215 Da
  • Monoisotopic mass214.084122 Da
  • ChemSpider ID74052531

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2S,3S,4S)-4-Acetyl-3,4-dimethyl-5-oxotetrahydro-2-furanyl acetate [ACD/IUPAC Name]
(2S,3S,4S)-4-Acetyl-3,4-dimethyl-5-oxotetrahydro-2-furanyl-acetat [German] [ACD/IUPAC Name]
2(3H)-Furanone, 3-acetyl-5-(acetyloxy)dihydro-3,4-dimethyl-, (3S,4S,5S)- [ACD/Index Name]
Acétate de (2S,3S,4S)-4-acétyl-3,4-diméthyl-5-oxotétrahydro-2-furanyle [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 336.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.9±3.0 kJ/mol
Flash Point: 148.9±27.9 °C
Index of Refraction: 1.466
Molar Refractivity: 50.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.41
ACD/LogD (pH 5.5): -0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 16.33
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 16.33
Polar Surface Area: 70 Å2
Polarizability: 19.9±0.5 10-24cm3
Surface Tension: 38.2±5.0 dyne/cm
Molar Volume: 180.8±5.0 cm3

Click to predict properties on the Chemicalize site


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