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

Methyl [(3R,6S)-6-methoxy-6-{3-[(3R,6S)-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 ID129306162

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

[(3R,6S)-6-Méthoxy-6-{3-[(3R,6S)-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-[(3R,6S)-3,6-dihydro-6-propyl-1,2-dioxin-3-yl]propyl]-3,6-dihydro-6-methoxy-, methyl ester, (3R,6S)- [ACD/Index Name]
Methyl [(3R,6S)-6-methoxy-6-{3-[(3R,6S)-6-propyl-3,6-dihydro-1,2-dioxin-3-yl]propyl}-3,6-dihydro-1,2-dioxin-3-yl]acetate [ACD/IUPAC Name]
Methyl-[(3R,6S)-6-methoxy-6-{3-[(3R,6S)-6-propyl-3,6-dihydro-1,2-dioxin-3-yl]propyl}-3,6-dihydro-1,2-dioxin-3-yl]acetat [German] [ACD/IUPAC Name]

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

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

Click to predict properties on the Chemicalize site


Advertisement