ChemSpider 2D Image | (2S,4S)-4-Hydroxy-5-oxotetrahydro-2-furancarboxylic acid | C5H6O5

(2S,4S)-4-Hydroxy-5-oxotetrahydro-2-furancarboxylic acid

  • Molecular FormulaC5H6O5
  • Average mass146.098 Da
  • Monoisotopic mass146.021530 Da
  • ChemSpider ID24191294

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,4S)-4-Hydroxy-5-oxotetrahydro-2-furancarbonsäure [German] [ACD/IUPAC Name]
(2S,4S)-4-Hydroxy-5-oxotetrahydro-2-furancarboxylic acid [ACD/IUPAC Name]
Acide (2S,4S)-4-hydroxy-5-oxotétrahydro-2-furanecarboxylique [French] [ACD/IUPAC Name]
(2S,4S)-4-hydroxy-5-oxotetrahydrofuran-2-carboxylic acid
120742-25-8 [RN]
threo-Pentaric acid, 3-deoxy-, 1,4-lactone (9CI)

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

Density: 1.7±0.1 g/cm3
Boiling Point: 443.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±6.0 kJ/mol
Flash Point: 199.9±22.2 °C
Index of Refraction: 1.566
Molar Refractivity: 27.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -2.17
ACD/LogD (pH 5.5): -4.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 11.1±0.5 10-24cm3
Surface Tension: 87.2±3.0 dyne/cm
Molar Volume: 85.5±3.0 cm3

Click to predict properties on the Chemicalize site


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