ChemSpider 2D Image | (4xi)-2-Deoxy-D-glycero-pentitol | C5H12O4

(4ξ)-2-Deoxy-D-glycero-pentitol

  • Molecular FormulaC5H12O4
  • Average mass136.146 Da
  • Monoisotopic mass136.073563 Da
  • ChemSpider ID75145877
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






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

(4ξ)-2-Deoxy-D-glycero-pentitol [ACD/IUPAC Name]
(4ξ)-2-Desoxy-D-glycero-pentitol [German] [ACD/IUPAC Name]
(4ξ)-2-Désoxy-D-glycéro-pentitol [French] [ACD/IUPAC Name]
D-glycero-Pentitol, 2-deoxy-, (4ξ)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 405.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 75.9±6.0 kJ/mol
Flash Point: 214.3±21.9 °C
Index of Refraction: 1.526
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.84
ACD/LogD (pH 5.5): -1.96
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.04
ACD/LogD (pH 7.4): -1.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.04
Polar Surface Area: 81 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 68.3±3.0 dyne/cm
Molar Volume: 101.8±3.0 cm3

Click to predict properties on the Chemicalize site






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