ChemSpider 2D Image | 2,5-Anhydro-4-deoxy-D-erythro-pent-4-enitol | C5H8O3

2,5-Anhydro-4-deoxy-D-erythro-pent-4-enitol

  • Molecular FormulaC5H8O3
  • Average mass116.115 Da
  • Monoisotopic mass116.047340 Da
  • ChemSpider ID25057901

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

2,5-Anhydro-4-deoxy-D-erythro-pent-4-enitol [ACD/IUPAC Name]
2,5-Anhydro-4-desoxy-D-erythro-pent-4-enitol [German] [ACD/IUPAC Name]
2,5-Anhydro-4-désoxy-D-érythro-pent-4-énitol [French] [ACD/IUPAC Name]
D-erythro-Pent-4-enitol, 2,5-anhydro-4-deoxy- [ACD/Index Name]
817621-88-8 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 260.9±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 57.9±6.0 kJ/mol
Flash Point: 111.6±27.3 °C
Index of Refraction: 1.532
Molar Refractivity: 27.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -1.40
ACD/LogD (pH 5.5): -1.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 6.37
ACD/LogD (pH 7.4): -1.05
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.37
Polar Surface Area: 50 Å2
Polarizability: 10.9±0.5 10-24cm3
Surface Tension: 57.4±3.0 dyne/cm
Molar Volume: 88.6±3.0 cm3

Click to predict properties on the Chemicalize site


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