ChemSpider 2D Image | (5xi)-3-O-Acetyl-1,2-O-isopropylidene-alpha-D-xylo-hexofuranose | C11H18O7

(5ξ)-3-O-Acetyl-1,2-O-isopropylidene-α-D-xylo-hexofuranose

  • Molecular FormulaC11H18O7
  • Average mass262.256 Da
  • Monoisotopic mass262.105255 Da
  • ChemSpider ID29786797

  • defined stereocentres - 2 of 5 defined stereocentres

More details:

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

(5ξ)-3-O-Acetyl-1,2-O-isopropylidene-α-D-xylo-hexofuranose [ACD/IUPAC Name]
(5ξ)-3-O-Acétyl-1,2-O-isopropylidène-α-D-xylo-hexofuranose [French] [ACD/IUPAC Name]
(5ξ)-3-O-Acetyl-1,2-O-isopropyliden-α-D-xylo-hexofuranose [German] [ACD/IUPAC Name]
α-D-xylo-Hexofuranose, 1,2-O-(1-methylethylidene)-, 3-acetate, (5ξ)- [ACD/Index Name]
3-O-Acetyl-1,2-O-isopropylidene-a-D-glucofuranose

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

Density: 1.4±0.1 g/cm3
Boiling Point: 392.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 74.2±6.0 kJ/mol
Flash Point: 148.4±21.4 °C
Index of Refraction: 1.521
Molar Refractivity: 58.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.43
ACD/LogD (pH 5.5): 0.43
ACD/BCF (pH 5.5): 1.25
ACD/KOC (pH 5.5): 40.85
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 40.85
Polar Surface Area: 94 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 193.4±5.0 cm3

Click to predict properties on the Chemicalize site


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