ChemSpider 2D Image | 8-(4-Isopropylphenyl)-8-oxooctanoic acid | C17H24O3

8-(4-Isopropylphenyl)-8-oxooctanoic acid

  • Molecular FormulaC17H24O3
  • Average mass276.371 Da
  • Monoisotopic mass276.172546 Da
  • ChemSpider ID21401797

More details:

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

8-(4-Isopropylphenyl)-8-oxooctanoic acid [ACD/IUPAC Name]
8-(4-Isopropylphenyl)-8-oxooctansäure [German] [ACD/IUPAC Name]
898791-41-8 [RN]
Acide 8-(4-isopropylphényl)-8-oxooctanoïque [French] [ACD/IUPAC Name]
Benzeneoctanoic acid, 4-(1-methylethyl)-η-oxo- [ACD/Index Name]
8-oxo-8-(4-propan-2-ylphenyl)octanoic acid
8-Oxo-8-[4-(propan-2-yl)phenyl]octanoic acid
MFCD02260956 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 445.4±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.1±3.0 kJ/mol
Flash Point: 237.3±20.5 °C
Index of Refraction: 1.515
Molar Refractivity: 79.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 3.20
ACD/BCF (pH 5.5): 101.34
ACD/KOC (pH 5.5): 558.88
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 1.62
ACD/KOC (pH 7.4): 8.94
Polar Surface Area: 54 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 40.6±3.0 dyne/cm
Molar Volume: 264.7±3.0 cm3

Click to predict properties on the Chemicalize site


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