ChemSpider 2D Image | L-Idaric acid 1,4-lactone | C6H8O8

L-Idaric acid 1,4-lactone

  • Molecular FormulaC6H8O8
  • Average mass208.123 Da
  • Monoisotopic mass208.021912 Da
  • ChemSpider ID32816501

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2R)-Hydroxy[(2S,3R,4R)-2,3,4-trihydroxy-5-oxotetrahydro-2-furanyl]acetic acid [ACD/IUPAC Name]
(2R)-Hydroxy[(2S,3R,4R)-2,3,4-trihydroxy-5-oxotetrahydro-2-furanyl]essigsäure [German] [ACD/IUPAC Name]
80876-59-1 [RN]
Acide (2R)-hydroxy[(2S,3R,4R)-2,3,4-trihydroxy-5-oxotétrahydro-2-furanyl]acétique [French] [ACD/IUPAC Name]
L-Idaric acid 1,4-lactone
[80876-59-1] [RN]
1932175-85-3 [RN]
L-Idaric-1,4-lactone
L-Idaro-1,4-lactone
MFCD09836208

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

Density: 2.2±0.1 g/cm3
Boiling Point: 615.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 104.7±6.0 kJ/mol
Flash Point: 259.0±22.2 °C
Index of Refraction: 1.728
Molar Refractivity: 37.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: -1.09
ACD/LogD (pH 5.5): -5.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.79
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 14.7±0.5 10-24cm3
Surface Tension: 189.8±3.0 dyne/cm
Molar Volume: 93.4±3.0 cm3

Click to predict properties on the Chemicalize site


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