ChemSpider 2D Image | 3H-Cyclopenta[a]azulen-3-one | C13H8O

3H-Cyclopenta[a]azulen-3-one

  • Molecular FormulaC13H8O
  • Average mass180.202 Da
  • Monoisotopic mass180.057510 Da
  • ChemSpider ID28684915

More details:

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

3H-Cyclopent[a]azulen-3-one [ACD/Index Name]
3H-Cyclopenta[a]azulen-3-on [German] [ACD/IUPAC Name]
3H-Cyclopenta[a]azulen-3-one [ACD/IUPAC Name]
3H-Cyclopenta[a]azulén-3-one [French] [ACD/IUPAC Name]
140666-49-5 [RN]
CYCLOPENTA[A]AZULEN-3-ONE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 364.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.1±3.0 kJ/mol
Flash Point: 162.9±18.1 °C
Index of Refraction: 1.716
Molar Refractivity: 56.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.45
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 169.59
ACD/KOC (pH 5.5): 1372.19
ACD/LogD (pH 7.4): 3.24
ACD/BCF (pH 7.4): 169.59
ACD/KOC (pH 7.4): 1372.19
Polar Surface Area: 17 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 142.4±3.0 cm3

Click to predict properties on the Chemicalize site


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