ChemSpider 2D Image | 1,5-Anhydro-3-C-carboxy-3-O-(2-chloroethyl)-2-deoxy-4-O-methylpentitol | C9H15ClO5

1,5-Anhydro-3-C-carboxy-3-O-(2-chloroethyl)-2-deoxy-4-O-methylpentitol

  • Molecular FormulaC9H15ClO5
  • Average mass238.665 Da
  • Monoisotopic mass238.060806 Da
  • ChemSpider ID110499991

More details:

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

1,5-Anhydro-3-C-carboxy-3-O-(2-chlorethyl)-2-desoxy-4-O-methylpentitol [German] [ACD/IUPAC Name]
1,5-Anhydro-3-C-carboxy-3-O-(2-chloroethyl)-2-deoxy-4-O-methylpentitol [ACD/IUPAC Name]
1,5-Anhydro-3-C-carboxy-3-O-(2-chloroéthyl)-2-désoxy-4-O-méthylpentitol [French] [ACD/IUPAC Name]
Pentitol, 1,5-anhydro-3-C-carboxy-3-O-(2-chloroethyl)-2-deoxy-4-O-methyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 376.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 68.5±6.0 kJ/mol
Flash Point: 181.3±27.9 °C
Index of Refraction: 1.489
Molar Refractivity: 53.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -2.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 65 Å2
Polarizability: 21.2±0.5 10-24cm3
Surface Tension: 44.4±5.0 dyne/cm
Molar Volume: 184.9±5.0 cm3

Click to predict properties on the Chemicalize site


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