ChemSpider 2D Image | 1-Ethynylcubane | C10H8

1-Ethynylcubane

  • Molecular FormulaC10H8
  • Average mass128.171 Da
  • Monoisotopic mass128.062607 Da
  • ChemSpider ID24184182

More details:

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

1-Ethinylcuban [German] [ACD/IUPAC Name]
1-Ethynylcubane [ACD/IUPAC Name]
1-Éthynylcubane [French] [ACD/IUPAC Name]
Pentacyclo[4.2.0.02,5.03,8.04,7]octane, 1-ethynyl- [ACD/Index Name]
163332-93-2 [RN]
Pentacyclo[4.2.0.02,5.03,8.04,7]octane, ethynyl- (9CI)

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

Density: 1.4±0.1 g/cm3
Boiling Point: 156.7±7.0 °C at 760 mmHg
Vapour Pressure: 3.7±0.1 mmHg at 25°C
Enthalpy of Vaporization: 37.7±0.8 kJ/mol
Flash Point: 34.1±12.3 °C
Index of Refraction: 1.732
Molar Refractivity: 35.8±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): 1.58
ACD/BCF (pH 5.5): 9.30
ACD/KOC (pH 5.5): 171.77
ACD/LogD (pH 7.4): 1.58
ACD/BCF (pH 7.4): 9.30
ACD/KOC (pH 7.4): 171.77
Polar Surface Area: 0 Å2
Polarizability: 14.2±0.5 10-24cm3
Surface Tension: 55.6±5.0 dyne/cm
Molar Volume: 89.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement