ChemSpider 2D Image | 11-[3-Hydroxy-2,2-bis(hydroxymethyl)propoxy]undecanoic acid | C16H32O6

11-[3-Hydroxy-2,2-bis(hydroxymethyl)propoxy]undecanoic acid

  • Molecular FormulaC16H32O6
  • Average mass320.422 Da
  • Monoisotopic mass320.219879 Da
  • ChemSpider ID28576167

More details:

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

11-[3-Hydroxy-2,2-bis(hydroxymethyl)propoxy]undecanoic acid [ACD/IUPAC Name]
11-[3-Hydroxy-2,2-bis(hydroxymethyl)propoxy]undecansäure [German] [ACD/IUPAC Name]
Acide 11-[3-hydroxy-2,2-bis(hydroxyméthyl)propoxy]undécanoïque [French] [ACD/IUPAC Name]
Undecanoic acid, 11-[3-hydroxy-2,2-bis(hydroxymethyl)propoxy]- [ACD/Index Name]
628314-96-5 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 536.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 93.5±6.0 kJ/mol
Flash Point: 188.9±22.2 °C
Index of Refraction: 1.499
Molar Refractivity: 84.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 0
ACD/LogP: 2.42
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 20.37
ACD/LogD (pH 7.4): -1.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 107 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 286.2±3.0 cm3

Click to predict properties on the Chemicalize site


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