ChemSpider 2D Image | (2S)-2-Fluorosuccinic acid | C4H5FO4

(2S)-2-Fluorosuccinic acid

  • Molecular FormulaC4H5FO4
  • Average mass136.079 Da
  • Monoisotopic mass136.017181 Da
  • ChemSpider ID32989990

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Fluorbernsteinsäure [German] [ACD/IUPAC Name]
(2S)-2-fluorobutanedioic acid
(2S)-2-Fluorosuccinic acid [ACD/IUPAC Name]
26109-19-3 [RN]
Acide (2S)-2-fluorosuccinique [French] [ACD/IUPAC Name]
Butanedioic acid, 2-fluoro-, (2S)- [ACD/Index Name]
(S)-2-FLUOROBUTANEDIOIC ACID
Butanedioic acid, fluoro-, (S)- (9CI)

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 248.4±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 53.5±6.0 kJ/mol
    Flash Point: 104.0±21.8 °C
    Index of Refraction: 1.444
    Molar Refractivity: 23.8±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: -0.13
    ACD/LogD (pH 5.5): -4.45
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -5.11
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 75 Å2
    Polarizability: 9.4±0.5 10-24cm3
    Surface Tension: 52.9±3.0 dyne/cm
    Molar Volume: 89.6±3.0 cm3

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