ChemSpider 2D Image | (1S,2R)-2-Fluoro-1-methylcyclopropanecarboxylic acid | C5H7FO2

(1S,2R)-2-Fluoro-1-methylcyclopropanecarboxylic acid

  • Molecular FormulaC5H7FO2
  • Average mass118.106 Da
  • Monoisotopic mass118.043007 Da
  • ChemSpider ID32056193

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2R)-2-Fluor-1-methylcyclopropancarbonsäure [German] [ACD/IUPAC Name]
(1S,2R)-2-fluoro-1-methylcyclopropane-1-carboxylic acid
(1S,2R)-2-Fluoro-1-methylcyclopropanecarboxylic acid [ACD/IUPAC Name]
128230-88-6 [RN]
Acide (1S,2R)-2-fluoro-1-méthylcyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-fluoro-1-methyl-, (1S,2R)- [ACD/Index Name]
MFCD28100746 [MDL number]
trans-2-Fluoro-1-methylcyclopropanecarboxylic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 187.8±33.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.7 mmHg at 25°C
Enthalpy of Vaporization: 46.7±6.0 kJ/mol
Flash Point: 67.4±25.4 °C
Index of Refraction: 1.445
Molar Refractivity: 24.9±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.13
ACD/LogD (pH 5.5): -0.67
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.76
ACD/LogD (pH 7.4): -2.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 9.9±0.5 10-24cm3
Surface Tension: 34.1±5.0 dyne/cm
Molar Volume: 93.6±5.0 cm3

Click to predict properties on the Chemicalize site


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