ChemSpider 2D Image | 1-Oxo-1,2,4,5-tetrahydro-2a(3H)-acenaphthylenecarboxylic acid | C13H12O3

1-Oxo-1,2,4,5-tetrahydro-2a(3H)-acenaphthylenecarboxylic acid

  • Molecular FormulaC13H12O3
  • Average mass216.233 Da
  • Monoisotopic mass216.078644 Da
  • ChemSpider ID21137760

More details:

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

1-Oxo-1,2,4,5-tetrahydro-2a(3H)-acenaphthylencarbonsäure [German] [ACD/IUPAC Name]
1-Oxo-1,2,4,5-tetrahydro-2a(3H)-acenaphthylenecarboxylic acid [ACD/IUPAC Name]
2a(3H)-Acenaphthylenecarboxylic acid, 1,2,4,5-tetrahydro-1-oxo- [ACD/Index Name]
Acide 1-oxo-1,2,4,5-tétrahydro-2a(3H)-acénaphtylènecarboxylique [French] [ACD/IUPAC Name]
1-Oxo-1,2,4,5-tetrahydroacenaphthylene-2a(3H)-carboxylic acid
6533-12-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 439.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.5±3.0 kJ/mol
Flash Point: 234.0±25.2 °C
Index of Refraction: 1.658
Molar Refractivity: 56.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): 0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.04
ACD/LogD (pH 7.4): -1.21
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 70.4±3.0 dyne/cm
Molar Volume: 153.7±3.0 cm3

Click to predict properties on the Chemicalize site


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