ChemSpider 2D Image | 1,4:3,6-Dianhydro-5-O-(2-hydroxybenzoyl)-2-O-(4-morpholinylcarbonyl)-D-glucitol | C18H21NO8

1,4:3,6-Dianhydro-5-O-(2-hydroxybenzoyl)-2-O-(4-morpholinylcarbonyl)-D-glucitol

  • Molecular FormulaC18H21NO8
  • Average mass379.361 Da
  • Monoisotopic mass379.126709 Da
  • ChemSpider ID24642686
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

1,4:3,6-Dianhydro-5-O-(2-hydroxybenzoyl)-2-O-(4-morpholinylcarbonyl)-D-glucitol [German] [ACD/IUPAC Name]
1,4:3,6-Dianhydro-5-O-(2-hydroxybenzoyl)-2-O-(4-morpholinylcarbonyl)-D-glucitol [ACD/IUPAC Name]
1,4:3,6-Dianhydro-5-O-(2-hydroxybenzoyl)-2-O-(4-morpholinylcarbonyl)-D-glucitol [French] [ACD/IUPAC Name]
D-Glucitol, 1,4:3,6-dianhydro-2-O-(4-morpholinylcarbonyl)-, 5-(2-hydroxybenzoate) [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 539.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 280.2±30.1 °C
Index of Refraction: 1.611
Molar Refractivity: 90.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.03
ACD/LogD (pH 5.5): 1.84
ACD/BCF (pH 5.5): 14.80
ACD/KOC (pH 5.5): 239.23
ACD/LogD (pH 7.4): 1.74
ACD/BCF (pH 7.4): 11.53
ACD/KOC (pH 7.4): 186.47
Polar Surface Area: 104 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 65.6±5.0 dyne/cm
Molar Volume: 260.5±5.0 cm3

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