ChemSpider 2D Image | 8-(3,4-Dimethoxyphenyl)-8-oxooctanoic acid | C16H22O5

8-(3,4-Dimethoxyphenyl)-8-oxooctanoic acid

  • Molecular FormulaC16H22O5
  • Average mass294.343 Da
  • Monoisotopic mass294.146729 Da
  • ChemSpider ID21401848

More details:






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

8-(3,4-Dimethoxyphenyl)-8-oxooctanoic acid [ACD/IUPAC Name]
8-(3,4-Dimethoxyphenyl)-8-oxooctansäure [German] [ACD/IUPAC Name]
Acide 8-(3,4-diméthoxyphényl)-8-oxooctanoïque [French] [ACD/IUPAC Name]
Benzeneoctanoic acid, 3,4-dimethoxy-η-oxo- [ACD/Index Name]
32246-94-9 [RN]
97%
MFCD02261044 [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: 475.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 171.7±19.4 °C
Index of Refraction: 1.513
Molar Refractivity: 79.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.91
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 7.75
ACD/KOC (pH 5.5): 88.79
ACD/LogD (pH 7.4): -0.07
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.42
Polar Surface Area: 73 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 262.6±3.0 cm3

Click to predict properties on the Chemicalize site






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