ChemSpider 2D Image | (2R,3S)-2-(2-Fluoro-2-propanyl)-3-hydroxysuccinic acid | C7H11FO5

(2R,3S)-2-(2-Fluoro-2-propanyl)-3-hydroxysuccinic acid

  • Molecular FormulaC7H11FO5
  • Average mass194.158 Da
  • Monoisotopic mass194.059052 Da
  • ChemSpider ID110569710

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-2-(2-Fluor-2-propanyl)-3-hydroxybernsteinsäure [German] [ACD/IUPAC Name]
(2R,3S)-2-(2-Fluoro-2-propanyl)-3-hydroxysuccinic acid [ACD/IUPAC Name]
Acide (2R,3S)-2-(2-fluoro-2-propanyl)-3-hydroxysuccinique [French] [ACD/IUPAC Name]
Butanedioic acid, 2-(1-fluoro-1-methylethyl)-3-hydroxy-, (2R,3S)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 336.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.1±6.0 kJ/mol
Flash Point: 157.2±27.9 °C
Index of Refraction: 1.484
Molar Refractivity: 39.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.22
ACD/LogD (pH 5.5): -3.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 53.3±3.0 dyne/cm
Molar Volume: 137.1±3.0 cm3

Click to predict properties on the Chemicalize site


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