ChemSpider 2D Image | 5-Fluoro-Alpha-L-Idopyranosyluronic Acid Fluoride | C6H8F2O6

5-Fluoro-α-L-Idopyranosyluronic Acid Fluoride

  • Molecular FormulaC6H8F2O6
  • Average mass214.121 Da
  • Monoisotopic mass214.028900 Da
  • ChemSpider ID35033867

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

(2S,3S,4R,5R,6S)-2,6-Difluor-3,4,5-trihydroxytetrahydro-2H-pyran-2-carbonsäure (non-preferred name) [German] [ACD/IUPAC Name]
(2S,3S,4R,5R,6S)-2,6-Difluoro-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid (non-preferred name) [ACD/IUPAC Name]
5-Fluoro-α-L-Idopyranosyluronic Acid Fluoride
Acide (2S,3S,4R,5R,6S)-2,6-difluoro-3,4,5-trihydroxytétrahydro-2H-pyrane-2-carboxylique (non-preferred name) [French] [ACD/IUPAC Name]
574752-49-1 [RN]
IDF

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

Density: 1.8±0.1 g/cm3
Boiling Point: 417.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.5±6.0 kJ/mol
Flash Point: 206.5±28.7 °C
Index of Refraction: 1.529
Molar Refractivity: 35.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.67
ACD/LogD (pH 5.5): -4.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 73.1±5.0 dyne/cm
Molar Volume: 116.5±5.0 cm3

Click to predict properties on the Chemicalize site


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