ChemSpider 2D Image | 3-(2-Hydroxyethyl)-2,2-bis(hydroxymethyl)-1,5-pentanediol | C9H20O5

3-(2-Hydroxyethyl)-2,2-bis(hydroxymethyl)-1,5-pentanediol

  • Molecular FormulaC9H20O5
  • Average mass208.252 Da
  • Monoisotopic mass208.131073 Da
  • ChemSpider ID25058441

More details:

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

1,5-Pentanediol, 3-(2-hydroxyethyl)-2,2-bis(hydroxymethyl)- [ACD/Index Name]
3-(2-Hydroxyethyl)-2,2-bis(hydroxymethyl)-1,5-pentandiol [German] [ACD/IUPAC Name]
3-(2-Hydroxyethyl)-2,2-bis(hydroxymethyl)-1,5-pentanediol [ACD/IUPAC Name]
3-(2-Hydroxyéthyl)-2,2-bis(hydroxyméthyl)-1,5-pentanediol [French] [ACD/IUPAC Name]
3-(2-Hydroxyethyl)-2,2-Bis(Hydroxymethyl)pentane-1,5-Diol
YES

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

Density: 1.3±0.1 g/cm3
Boiling Point: 474.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.0±6.0 kJ/mol
Flash Point: 237.5±21.9 °C
Index of Refraction: 1.534
Molar Refractivity: 51.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -3.45
ACD/LogD (pH 5.5): -1.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.13
ACD/LogD (pH 7.4): -1.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.13
Polar Surface Area: 101 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 165.1±3.0 cm3

Click to predict properties on the Chemicalize site


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