ChemSpider 2D Image | Methyl 4-(4-ethoxy-4-oxobutoxy)-3,5-dimethoxybenzoate | C16H22O7

Methyl 4-(4-ethoxy-4-oxobutoxy)-3,5-dimethoxybenzoate

  • Molecular FormulaC16H22O7
  • Average mass326.342 Da
  • Monoisotopic mass326.136566 Da
  • ChemSpider ID28595609

More details:

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

4-(4-Éthoxy-4-oxobutoxy)-3,5-diméthoxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-(4-ethoxy-4-oxobutoxy)-3,5-dimethoxy-, methyl ester [ACD/Index Name]
Methyl 4-(4-ethoxy-4-oxobutoxy)-3,5-dimethoxybenzoate [ACD/IUPAC Name]
Methyl-4-(4-ethoxy-4-oxobutoxy)-3,5-dimethoxybenzoat [German] [ACD/IUPAC Name]
918668-62-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 403.3±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 174.9±22.9 °C
Index of Refraction: 1.494
Molar Refractivity: 83.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 2.42
ACD/BCF (pH 5.5): 40.35
ACD/KOC (pH 5.5): 491.00
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 40.35
ACD/KOC (pH 7.4): 491.00
Polar Surface Area: 80 Å2
Polarizability: 32.9±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 285.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement