ChemSpider 2D Image | 2'-Hydroxy-1,1'-binaphthalen-2-yl (1R,2S)-2-ethynylcyclopropanecarboxylate | C26H18O3

2'-Hydroxy-1,1'-binaphthalen-2-yl (1R,2S)-2-ethynylcyclopropanecarboxylate

  • Molecular FormulaC26H18O3
  • Average mass378.419 Da
  • Monoisotopic mass378.125580 Da
  • ChemSpider ID30656702

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,2S)-2-Éthynylcyclopropanecarboxylate de 2'-hydroxy-1,1'-binaphtalén-2-yle [French] [ACD/IUPAC Name]
2'-Hydroxy-1,1'-binaphthalen-2-yl (1R,2S)-2-ethynylcyclopropanecarboxylate [ACD/IUPAC Name]
2'-Hydroxy-1,1'-binaphthalin-2-yl-(1R,2S)-2-ethinylcyclopropancarboxylat [German] [ACD/IUPAC Name]
Cyclopropanecarboxylic acid, 2-ethynyl-, 2'-hydroxy[1,1'-binaphthalen]-2-yl ester, (1R,2S)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 544.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.4±3.0 kJ/mol
Flash Point: 220.4±22.9 °C
Index of Refraction: 1.739
Molar Refractivity: 113.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.04
ACD/LogD (pH 5.5): 5.38
ACD/BCF (pH 5.5): 7241.54
ACD/KOC (pH 5.5): 20152.96
ACD/LogD (pH 7.4): 5.35
ACD/BCF (pH 7.4): 6732.72
ACD/KOC (pH 7.4): 18736.93
Polar Surface Area: 47 Å2
Polarizability: 45.0±0.5 10-24cm3
Surface Tension: 69.2±5.0 dyne/cm
Molar Volume: 281.7±5.0 cm3

Click to predict properties on the Chemicalize site


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