ChemSpider 2D Image | Methyl {6-methoxy-6-[3-(6-propyl-3,6-dihydro-1,2-dioxin-3-yl)propyl]-3,6-dihydro-1,2-dioxin-3-yl}acetate | C18H28O7

Methyl {6-methoxy-6-[3-(6-propyl-3,6-dihydro-1,2-dioxin-3-yl)propyl]-3,6-dihydro-1,2-dioxin-3-yl}acetate

  • Molecular FormulaC18H28O7
  • Average mass356.411 Da
  • Monoisotopic mass356.183502 Da
  • ChemSpider ID57641940

More details:






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

{6-Méthoxy-6-[3-(6-propyl-3,6-dihydro-1,2-dioxin-3-yl)propyl]-3,6-dihydro-1,2-dioxin-3-yl}acétate de méthyle [French] [ACD/IUPAC Name]
1,2-Dioxin-3-acetic acid, 6-[3-(3,6-dihydro-6-propyl-1,2-dioxin-3-yl)propyl]-3,6-dihydro-6-methoxy-, methyl ester [ACD/Index Name]
Methyl {6-methoxy-6-[3-(6-propyl-3,6-dihydro-1,2-dioxin-3-yl)propyl]-3,6-dihydro-1,2-dioxin-3-yl}acetate [ACD/IUPAC Name]
Methyl-{6-methoxy-6-[3-(6-propyl-3,6-dihydro-1,2-dioxin-3-yl)propyl]-3,6-dihydro-1,2-dioxin-3-yl}acetat [German] [ACD/IUPAC Name]
154702-58-6 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 397.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.8±3.0 kJ/mol
Flash Point: 169.6±27.9 °C
Index of Refraction: 1.503
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 2.47
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 64.55
ACD/KOC (pH 5.5): 687.31
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 64.55
ACD/KOC (pH 7.4): 687.31
Polar Surface Area: 72 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 41.1±5.0 dyne/cm
Molar Volume: 309.9±5.0 cm3

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