ChemSpider 2D Image | (2R)-2-Deoxy-2-fluoro-2-methyl-D-erythro-pentonic acid γ-lactone | C6H9FO4

(2R)-2-Deoxy-2-fluoro-2-methyl-D-erythro-pentonic acid γ-lactone

  • Molecular FormulaC6H9FO4
  • Average mass164.132 Da
  • Monoisotopic mass164.048492 Da
  • ChemSpider ID21179586

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R)-2-Deoxy-2-fluoro-2-methyl-D-erythro-pentonic acid γ-lactone
(3R,4R,5R)-3-Fluor-4-hydroxy-5-(hydroxymethyl)-3-methyldihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(3R,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyldihydro-2(3H)-furanone [ACD/IUPAC Name]
(3R,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxyméthyl)-3-méthyldihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
(3R,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-one
879551-04-9 [RN]
(3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyldihydrofuran-2(3H)-one
(3R,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyl-dihydrofuran-2(3H)-one
(3R,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyloxolan-2-one (non-preferred name)
(3R,4R,5R)-3-Fluoro-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 352.7±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 69.2±6.0 kJ/mol
    Flash Point: 167.1±27.9 °C
    Index of Refraction: 1.483
    Molar Refractivity: 32.8±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: -1.70
    ACD/LogD (pH 5.5): -1.37
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 4.28
    ACD/LogD (pH 7.4): -1.37
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 4.28
    Polar Surface Area: 67 Å2
    Polarizability: 13.0±0.5 10-24cm3
    Surface Tension: 47.5±5.0 dyne/cm
    Molar Volume: 114.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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