ChemSpider 2D Image | 3-Deoxy-2-C-(3-hydroxypropyl)pentitol | C8H18O5

3-Deoxy-2-C-(3-hydroxypropyl)pentitol

  • Molecular FormulaC8H18O5
  • Average mass194.225 Da
  • Monoisotopic mass194.115417 Da
  • ChemSpider ID74941150

More details:






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

3-Deoxy-2-C-(3-hydroxypropyl)pentitol [ACD/IUPAC Name]
3-Desoxy-2-C-(3-hydroxypropyl)pentitol [German] [ACD/IUPAC Name]
3-Désoxy-2-C-(3-hydroxypropyl)pentitol [French] [ACD/IUPAC Name]
Pentitol, 3-deoxy-2-C-(3-hydroxypropyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 472.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.7±6.0 kJ/mol
Flash Point: 239.8±21.9 °C
Index of Refraction: 1.541
Molar Refractivity: 46.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -3.77
ACD/LogD (pH 5.5): -2.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.15
ACD/LogD (pH 7.4): -2.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.15
Polar Surface Area: 101 Å2
Polarizability: 18.5±0.5 10-24cm3
Surface Tension: 68.0±3.0 dyne/cm
Molar Volume: 148.5±3.0 cm3

Click to predict properties on the Chemicalize site






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