ChemSpider 2D Image | 5-[4-(Hexyloxy)phenyl]-5-oxopentanoic acid | C17H24O4

5-[4-(Hexyloxy)phenyl]-5-oxopentanoic acid

  • Molecular FormulaC17H24O4
  • Average mass292.370 Da
  • Monoisotopic mass292.167450 Da
  • ChemSpider ID21401826

More details:

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

5-[4-(Hexyloxy)phenyl]-5-oxopentanoic acid [ACD/IUPAC Name]
5-[4-(Hexyloxy)phenyl]-5-oxopentansäure [German] [ACD/IUPAC Name]
898792-09-1 [RN]
Acide 5-[4-(hexyloxy)phényl]-5-oxopentanoïque [French] [ACD/IUPAC Name]
Benzenepentanoic acid, 4-(hexyloxy)-δ-oxo- [ACD/Index Name]
5-(4-hexoxyphenyl)-5-oxopentanoic acid
5-(4-hexyloxyphenyl)-5-oxovaleric acid
MFCD02261004 [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: 474.7±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 169.3±16.7 °C
Index of Refraction: 1.513
Molar Refractivity: 81.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 46.39
ACD/KOC (pH 5.5): 291.88
ACD/LogD (pH 7.4): 0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.59
Polar Surface Area: 64 Å2
Polarizability: 32.3±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 271.6±3.0 cm3

Click to predict properties on the Chemicalize site


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