ChemSpider 2D Image | 4-Oxo-4-(9-phenanthryl)butanoic acid | C18H14O3

4-Oxo-4-(9-phenanthryl)butanoic acid

  • Molecular FormulaC18H14O3
  • Average mass278.302 Da
  • Monoisotopic mass278.094299 Da
  • ChemSpider ID21401681

More details:

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

4-Oxo-4-(9-phenanthryl)butanoic acid [ACD/IUPAC Name]
4-Oxo-4-(9-phenanthryl)butansäure [German] [ACD/IUPAC Name]
9-Phenanthrenebutanoic acid, γ-oxo- [ACD/Index Name]
Acide 4-oxo-4-(9-phénanthryl)butanoïque [French] [ACD/IUPAC Name]
4-oxo-4-(9-Phenanthryl)butyric acid
4-OXO-4-(PHENANTHREN-9-YL)BUTANOIC ACID
4-oxo-4-phenanthren-9-ylbutanoic acid
68151-15-5 [RN]
MFCD01320093 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 546.9±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.9±3.0 kJ/mol
Flash Point: 298.6±21.9 °C
Index of Refraction: 1.689
Molar Refractivity: 82.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 35.84
ACD/KOC (pH 5.5): 232.39
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.65
Polar Surface Area: 54 Å2
Polarizability: 32.8±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 216.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement