ChemSpider 2D Image | 3-(1-Chlorocyclopropyl)-2-propynoic acid | C6H5ClO2

3-(1-Chlorocyclopropyl)-2-propynoic acid

  • Molecular FormulaC6H5ClO2
  • Average mass144.556 Da
  • Monoisotopic mass143.997803 Da
  • ChemSpider ID26570677

More details:






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

2-Propynoic acid, 3-(1-chlorocyclopropyl)- [ACD/Index Name]
3-(1-Chlorcyclopropyl)-2-propinsäure [German] [ACD/IUPAC Name]
3-(1-Chlorocyclopropyl)-2-propynoic acid [ACD/IUPAC Name]
Acide 3-(1-chlorocyclopropyl)-2-propynoïque [French] [ACD/IUPAC Name]
83662-43-5 [RN]
MFCD19229169

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 287.5±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 57.9±6.0 kJ/mol
Flash Point: 127.6±21.5 °C
Index of Refraction: 1.564
Molar Refractivity: 32.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): -1.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.37
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 12.8±0.5 10-24cm3
Surface Tension: 59.4±5.0 dyne/cm
Molar Volume: 99.2±5.0 cm3

Click to predict properties on the Chemicalize site






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