ChemSpider 2D Image | Ethyl 8-(3,4-dimethoxyphenyl)-8-oxooctanoate | C18H26O5

Ethyl 8-(3,4-dimethoxyphenyl)-8-oxooctanoate

  • Molecular FormulaC18H26O5
  • Average mass322.396 Da
  • Monoisotopic mass322.178009 Da
  • ChemSpider ID21402380

More details:

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

8-(3,4-Diméthoxyphényl)-8-oxooctanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneoctanoic acid, 3,4-dimethoxy-η-oxo-, ethyl ester [ACD/Index Name]
Ethyl 8-(3,4-dimethoxyphenyl)-8-oxooctanoate [ACD/IUPAC Name]
Ethyl-8-(3,4-dimethoxyphenyl)-8-oxooctanoat [German] [ACD/IUPAC Name]
57641-19-7 [RN]
MFCD02261486 [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: 438.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 216.4±13.9 °C
Index of Refraction: 1.493
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 3.54
ACD/BCF (pH 5.5): 290.01
ACD/KOC (pH 5.5): 2014.64
ACD/LogD (pH 7.4): 3.54
ACD/BCF (pH 7.4): 290.01
ACD/KOC (pH 7.4): 2014.64
Polar Surface Area: 62 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 36.6±3.0 dyne/cm
Molar Volume: 304.5±3.0 cm3

Click to predict properties on the Chemicalize site


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