ChemSpider 2D Image | 1,2:5,6-Dianhydro-D-allitol | C6H10O4

1,2:5,6-Dianhydro-D-allitol

  • Molecular FormulaC6H10O4
  • Average mass146.141 Da
  • Monoisotopic mass146.057907 Da
  • ChemSpider ID32697607

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

1,2:5,6-Dianhydro-D-allitol [German] [ACD/IUPAC Name]
1,2:5,6-Dianhydro-D-allitol [ACD/IUPAC Name]
1,2:5,6-Dianhydro-D-allitol [French] [ACD/IUPAC Name]
D-Allitol, 1,2:5,6-dianhydro- [ACD/Index Name]
Dianhydrogalactitol [INN] [USAN]
UNII-4S465RYF7M

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

Density: 1.6±0.1 g/cm3
Boiling Point: 348.0±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 68.6±6.0 kJ/mol
Flash Point: 164.3±19.6 °C
Index of Refraction: 1.600
Molar Refractivity: 31.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.02
ACD/LogD (pH 5.5): -1.11
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.91
ACD/LogD (pH 7.4): -1.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.91
Polar Surface Area: 66 Å2
Polarizability: 12.6±0.5 10-24cm3
Surface Tension: 78.8±3.0 dyne/cm
Molar Volume: 93.2±3.0 cm3

Click to predict properties on the Chemicalize site


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