ChemSpider 2D Image | Ethyl 3-[(7-ethoxy-7-oxoheptyl)oxy]-4-methoxybenzoate | C19H28O6

Ethyl 3-[(7-ethoxy-7-oxoheptyl)oxy]-4-methoxybenzoate

  • Molecular FormulaC19H28O6
  • Average mass352.422 Da
  • Monoisotopic mass352.188599 Da
  • ChemSpider ID28535203

More details:

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

3-[(7-Éthoxy-7-oxoheptyl)oxy]-4-méthoxybenzoate d'éthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[(7-ethoxy-7-oxoheptyl)oxy]-4-methoxy-, ethyl ester [ACD/Index Name]
Ethyl 3-[(7-ethoxy-7-oxoheptyl)oxy]-4-methoxybenzoate [ACD/IUPAC Name]
Ethyl-3-[(7-ethoxy-7-oxoheptyl)oxy]-4-methoxybenzoat [German] [ACD/IUPAC Name]
[1012057-22-5] [RN]
1012057-22-5 [RN]
Ethyl 3-((7-ethoxy-7-oxoheptyl)oxy)-4- methoxybenzoate
Ethyl 3-((7-ethoxy-7-oxoheptyl)oxy)-4-methoxybenzoate
Ethyl 3-((7-ethoxy-7-oxoheptyl)-oxy)-4-methoxybenzoate
ethyl 3-(7-ethoxy-7-oxoheptoxy)-4-methoxybenzoate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 454.8±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.4±3.0 kJ/mol
Flash Point: 196.5±26.0 °C
Index of Refraction: 1.491
Molar Refractivity: 94.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 0
ACD/LogP: 4.67
ACD/LogD (pH 5.5): 4.15
ACD/BCF (pH 5.5): 836.98
ACD/KOC (pH 5.5): 4302.10
ACD/LogD (pH 7.4): 4.15
ACD/BCF (pH 7.4): 836.98
ACD/KOC (pH 7.4): 4302.10
Polar Surface Area: 71 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 327.4±3.0 cm3

Click to predict properties on the Chemicalize site


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