ChemSpider 2D Image | Ethyl 7-(4-methoxy-3,5-dimethylphenyl)-7-oxoheptanoate | C18H26O4

Ethyl 7-(4-methoxy-3,5-dimethylphenyl)-7-oxoheptanoate

  • Molecular FormulaC18H26O4
  • Average mass306.397 Da
  • Monoisotopic mass306.183105 Da
  • ChemSpider ID21402071

More details:

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

7-(4-Méthoxy-3,5-diméthylphényl)-7-oxoheptanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneheptanoic acid, 4-methoxy-3,5-dimethyl-ζ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 7-(4-methoxy-3,5-dimethylphenyl)-7-oxoheptanoate [ACD/IUPAC Name]
Ethyl-7-(4-methoxy-3,5-dimethylphenyl)-7-oxoheptanoat [German] [ACD/IUPAC Name]
898751-10-5 [RN]
ethyl 7-(3,5-dimethyl -4-methoxyphenyl )-7-oxoheptanoate
Ethyl 7-(3,5-dimethyl-4-methoxyphenyl)-7-oxoheptanoate
ethyl7-(3,5-dimethyl-4-methoxyphenyl)-7-oxoheptanoate
MFCD01320204 [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: 430.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.6±3.0 kJ/mol
Flash Point: 187.1±28.8 °C
Index of Refraction: 1.497
Molar Refractivity: 86.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.21
ACD/LogD (pH 5.5): 4.08
ACD/BCF (pH 5.5): 745.00
ACD/KOC (pH 5.5): 3958.15
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 745.00
ACD/KOC (pH 7.4): 3958.15
Polar Surface Area: 53 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 296.5±3.0 cm3

Click to predict properties on the Chemicalize site


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