ChemSpider 2D Image | Mannide monooleate | C24H44O7

Mannide monooleate

  • Molecular FormulaC24H44O7
  • Average mass444.602 Da
  • Monoisotopic mass444.308716 Da
  • ChemSpider ID34998030

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 5 defined stereocentres

More details:

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

1-O-[(9Z)-9-Octadecenoyl]-D-mannopyranose [German] [ACD/IUPAC Name]
1-O-[(9Z)-9-Octadecenoyl]-D-mannopyranose [ACD/IUPAC Name]
1-O-[(9Z)-9-Octadecenoyl]-D-mannopyranose [French] [ACD/IUPAC Name]
9049-98-3 [RN]
D-Mannopyranose, 1-O-[(9Z)-1-oxo-9-octadecen-1-yl]- [ACD/Index Name]
Mannide monooleate
[(3S,4S,5S,6R)-3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] (Z)-octadec-9-enoate
1-O-[(9Z)-9-Octadecenoyl]-D-glucopyranose [ACD/IUPAC Name]
25339-93-9 [RN]
Dianhydro-D-mannitol monooleate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 573.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.6 mmHg at 25°C
Enthalpy of Vaporization: 98.6±6.0 kJ/mol
Flash Point: 182.6±23.6 °C
Index of Refraction: 1.518
Molar Refractivity: 120.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 18
#Rule of 5 Violations: 1
ACD/LogP: 7.03
ACD/LogD (pH 5.5): 5.95
ACD/BCF (pH 5.5): 19406.63
ACD/KOC (pH 5.5): 40822.62
ACD/LogD (pH 7.4): 5.95
ACD/BCF (pH 7.4): 19406.39
ACD/KOC (pH 7.4): 40822.13
Polar Surface Area: 116 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 49.0±5.0 dyne/cm
Molar Volume: 398.2±5.0 cm3

Click to predict properties on the Chemicalize site


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