ChemSpider 2D Image | sucrose oleate | C30H54O12

sucrose oleate

  • Molecular FormulaC30H54O12
  • Average mass606.743 Da
  • Monoisotopic mass606.361511 Da
  • ChemSpider ID4955123

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-bis(hydroxymethyl)tetrahydro-2-furanyl]-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl (9Z)-9-octadecenoate [ACD/IUPAC Name]
(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-Dihydroxy-2,5-bis(hydroxymethyl)tetrahydro-2-furanyl]-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-2-yl-(9Z)-9-octadecenoat [German] [ACD/IUPAC Name]
(9Z)-9-Octadécénoate de (2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-dihydroxy-2,5-bis(hydroxyméthyl)tétrahydro-2-furanyl]-3,4,5-trihydroxy-6-(hydroxyméthyl)tétrahydro-2H-pyran-2-yle [French] [ACD/IUPAC Name]
52683-61-1 [RN]
sucrose oleate
α-D-gluco-D-manno-6-Undeculopyranose, 2,5-anhydro-5-C-(hydroxymethyl)-6-O-[(9Z)-1-oxo-9-octadecen-1-yl]- [ACD/Index Name]
(2S,3R,4S,5S,6R)-2-[(2S,3S,4S,5R)-3,4-DIHYDROXY-2,5-BIS(HYDROXYMETHYL)OXOLAN-2-YL]-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL (9Z)-OCTADEC-9-ENOATE
258-098-8 [EINECS]
α-D-Glucopyranoside, β-D-fructofuranosyl, (Z)-9-octadecenoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 772.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.0 mmHg at 25°C
Enthalpy of Vaporization: 128.1±6.0 kJ/mol
Flash Point: 239.5±26.4 °C
Index of Refraction: 1.566
Molar Refractivity: 154.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 4
ACD/LogP: 8.61
ACD/LogD (pH 5.5): 5.60
ACD/BCF (pH 5.5): 10538.02
ACD/KOC (pH 5.5): 26368.18
ACD/LogD (pH 7.4): 5.60
ACD/BCF (pH 7.4): 10537.80
ACD/KOC (pH 7.4): 26367.63
Polar Surface Area: 207 Å2
Polarizability: 61.2±0.5 10-24cm3
Surface Tension: 64.8±5.0 dyne/cm
Molar Volume: 472.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement