ChemSpider 2D Image | Ethyl 7-(2-methoxyphenyl)-7-oxoheptanoate | C16H22O4

Ethyl 7-(2-methoxyphenyl)-7-oxoheptanoate

  • Molecular FormulaC16H22O4
  • Average mass278.344 Da
  • Monoisotopic mass278.151794 Da
  • ChemSpider ID21402141

More details:

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

122115-56-4 [RN]
7-(2-Méthoxyphényl)-7-oxoheptanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneheptanoic acid, 2-methoxy-ζ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 7-(2-methoxyphenyl)-7-oxoheptanoate [ACD/IUPAC Name]
Ethyl-7-(2-methoxyphenyl)-7-oxoheptanoat [German] [ACD/IUPAC Name]
MFCD01311630 [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: 387.8±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 168.8±22.4 °C
Index of Refraction: 1.496
Molar Refractivity: 77.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 3.22
ACD/BCF (pH 5.5): 164.78
ACD/KOC (pH 5.5): 1344.23
ACD/LogD (pH 7.4): 3.22
ACD/BCF (pH 7.4): 164.78
ACD/KOC (pH 7.4): 1344.23
Polar Surface Area: 53 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 37.3±3.0 dyne/cm
Molar Volume: 264.0±3.0 cm3

Click to predict properties on the Chemicalize site


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