ChemSpider 2D Image | 3,7-Dimethyl-1,6-octadiene-3,4,5-triol | C10H18O3

3,7-Dimethyl-1,6-octadiene-3,4,5-triol

  • Molecular FormulaC10H18O3
  • Average mass186.248 Da
  • Monoisotopic mass186.125595 Da
  • ChemSpider ID74992518

More details:

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

1,6-Octadiene-3,4,5-triol, 3,7-dimethyl- [ACD/Index Name]
3,7-Dimethyl-1,6-octadien-3,4,5-triol [German] [ACD/IUPAC Name]
3,7-Dimethyl-1,6-octadiene-3,4,5-triol [ACD/IUPAC Name]
3,7-Diméthyl-1,6-octadiène-3,4,5-triol [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 329.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.3±6.0 kJ/mol
Flash Point: 157.2±21.1 °C
Index of Refraction: 1.510
Molar Refractivity: 52.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.27
ACD/LogD (pH 5.5): 1.35
ACD/BCF (pH 5.5): 6.20
ACD/KOC (pH 5.5): 128.41
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 6.20
ACD/KOC (pH 7.4): 128.41
Polar Surface Area: 61 Å2
Polarizability: 20.8±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 175.4±3.0 cm3

Click to predict properties on the Chemicalize site


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