ChemSpider 2D Image | 9-(Hydroxymethyl)-8-methoxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0~3,9~]non-1-yl hexopyranoside | C17H26O10

9-(Hydroxymethyl)-8-methoxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.03,9]non-1-yl hexopyranoside

  • Molecular FormulaC17H26O10
  • Average mass390.382 Da
  • Monoisotopic mass390.152588 Da
  • ChemSpider ID24629237

  • defined stereocentres - 9 of 10 defined stereocentres

More details:

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

7-Oxatricyclo[4.3.0.03,9]nonan-4-one, 1-(hexopyranosyloxy)-9-(hydroxymethyl)-8-methoxy-6-methyl- [ACD/Index Name]
9-(Hydroxymethyl)-8-methoxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.03,9]non-1-yl hexopyranoside [ACD/IUPAC Name]
9-(Hydroxymethyl)-8-methoxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.03,9]non-1-ylhexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside de 9-(hydroxyméthyl)-8-méthoxy-6-méthyl-4-oxo-7-oxatricyclo[4.3.0.03,9]non-1-yle [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 612.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.0 mmHg at 25°C
Enthalpy of Vaporization: 104.2±6.0 kJ/mol
Flash Point: 220.6±25.0 °C
Index of Refraction: 1.623
Molar Refractivity: 87.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -3.05
ACD/LogD (pH 5.5): -2.59
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 155 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 79.8±5.0 dyne/cm
Molar Volume: 247.3±5.0 cm3

Click to predict properties on the Chemicalize site


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