ChemSpider 2D Image | (2xi)-1,4-Anhydro-5,6-di-O-dodecanoyl-D-ribo-hexitol | C30H56O7

(2ξ)-1,4-Anhydro-5,6-di-O-dodecanoyl-D-ribo-hexitol

  • Molecular FormulaC30H56O7
  • Average mass528.761 Da
  • Monoisotopic mass528.402588 Da
  • ChemSpider ID107003

  • defined stereocentres - 3 of 4 defined stereocentres

More details:

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

(2ξ)-1,4-Anhydro-5,6-di-O-dodecanoyl-D-ribo-hexitol [ACD/IUPAC Name]
(2ξ)-1,4-Anhydro-5,6-di-O-dodecanoyl-D-ribo-hexitol [German] [ACD/IUPAC Name]
(2ξ)-1,4-Anhydro-5,6-di-O-dodecanoyl-D-ribo-hexitol [French] [ACD/IUPAC Name]
D-ribo-Heξtol, 1,4-anhydro-5,6-bis-O-(1-oxododecyl)-, (2ξ)- [ACD/Index Name]
(1R)-1-[(2S,3S)-3,4-DIHYDROXYOXOLAN-2-YL]-2-(DODECANOYLOXY)ETHYL DODECANOATE
Sorbitan, didodecanoate

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

Density: 1.0±0.1 g/cm3
Boiling Point: 623.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.8±6.0 kJ/mol
Flash Point: 187.1±23.6 °C
Index of Refraction: 1.486
Molar Refractivity: 147.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 9.85
ACD/LogD (pH 5.5): 9.86
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 5500241.00
ACD/LogD (pH 7.4): 9.86
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 5500235.00
Polar Surface Area: 102 Å2
Polarizability: 58.4±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 512.5±3.0 cm3

Click to predict properties on the Chemicalize site


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