ChemSpider 2D Image | 6-Oxo-6-(4-propylphenyl)hexanoic acid | C15H20O3

6-Oxo-6-(4-propylphenyl)hexanoic acid

  • Molecular FormulaC15H20O3
  • Average mass248.318 Da
  • Monoisotopic mass248.141251 Da
  • ChemSpider ID21401926

More details:

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

6-Oxo-6-(4-propylphenyl)hexanoic acid [ACD/IUPAC Name]
6-Oxo-6-(4-propylphenyl)hexansäure [German] [ACD/IUPAC Name]
951892-18-5 [RN]
Acide 6-oxo-6-(4-propylphényl)hexanoïque [French] [ACD/IUPAC Name]
Benzenehexanoic acid, ε-oxo-4-propyl- [ACD/Index Name]
6-(4-n-Propylphenyl)-6-oxohexanoic acid
MFCD02260950 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 433.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.7±3.0 kJ/mol
Flash Point: 230.0±23.3 °C
Index of Refraction: 1.523
Molar Refractivity: 70.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.48
ACD/LogD (pH 5.5): 2.49
ACD/BCF (pH 5.5): 28.04
ACD/KOC (pH 5.5): 212.43
ACD/LogD (pH 7.4): 0.69
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.36
Polar Surface Area: 54 Å2
Polarizability: 28.0±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 230.9±3.0 cm3

Click to predict properties on the Chemicalize site


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