ChemSpider 2D Image | (1S,2R)-2-(3-Chlorophenyl)cyclopropanecarboxylic acid | C10H9ClO2

(1S,2R)-2-(3-Chlorophenyl)cyclopropanecarboxylic acid

  • Molecular FormulaC10H9ClO2
  • Average mass196.630 Da
  • Monoisotopic mass196.029114 Da
  • ChemSpider ID110457413

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,2R)-2-(3-Chlorophenyl)cyclopropanecarboxylic acid [ACD/IUPAC Name]
(1S,2R)-2-(3-Chlorphenyl)cyclopropancarbonsäure [German] [ACD/IUPAC Name]
Acide (1S,2R)-2-(3-chlorophényl)cyclopropanecarboxylique [French] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-(3-chlorophenyl)-, (1S,2R)- [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: 345.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.3±3.0 kJ/mol
Flash Point: 163.0±27.9 °C
Index of Refraction: 1.613
Molar Refractivity: 49.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 3.58
ACD/KOC (pH 5.5): 44.31
ACD/LogD (pH 7.4): -0.45
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 141.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement