ChemSpider 2D Image | 5-(4-Formyl-2-methoxyphenoxy)pentanoic acid | C13H16O5

5-(4-Formyl-2-methoxyphenoxy)pentanoic acid

  • Molecular FormulaC13H16O5
  • Average mass252.263 Da
  • Monoisotopic mass252.099777 Da
  • ChemSpider ID25947499

More details:

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

5-(4-Formyl-2-methoxyphenoxy)pentanoic acid [ACD/IUPAC Name]
5-(4-Formyl-2-methoxyphenoxy)pentansäure [German] [ACD/IUPAC Name]
Acide 5-(4-formyl-2-méthoxyphénoxy)pentanoïque [French] [ACD/IUPAC Name]
Pentanoic acid, 5-(4-formyl-2-methoxyphenoxy)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 456.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 174.3±19.4 °C
Index of Refraction: 1.546
Molar Refractivity: 66.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 0.69
ACD/BCF (pH 5.5): 1.21
ACD/KOC (pH 5.5): 22.34
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 209.8±3.0 cm3

Click to predict properties on the Chemicalize site


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