ChemSpider 2D Image | (2R,3R)-3-Fluoro-2-azetidinecarboxylic acid | C4H6FNO2

(2R,3R)-3-Fluoro-2-azetidinecarboxylic acid

  • Molecular FormulaC4H6FNO2
  • Average mass119.094 Da
  • Monoisotopic mass119.038254 Da
  • ChemSpider ID32976902

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-3-Fluor-2-azetidincarbonsäure [German] [ACD/IUPAC Name]
(2R,3R)-3-Fluoro-2-azetidinecarboxylic acid [ACD/IUPAC Name]
2-Azetidinecarboxylic acid, 3-fluoro-, (2R,3R)- [ACD/Index Name]
Acide (2R,3R)-3-fluoro-2-azétidinecarboxylique [French] [ACD/IUPAC Name]
1354423-64-5 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 256.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 54.4±6.0 kJ/mol
Flash Point: 108.9±27.3 °C
Index of Refraction: 1.473
Molar Refractivity: 23.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.67
ACD/LogD (pH 5.5): -3.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 9.5±0.5 10-24cm3
Surface Tension: 41.5±5.0 dyne/cm
Molar Volume: 85.1±5.0 cm3

Click to predict properties on the Chemicalize site


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