ChemSpider 2D Image | 1-[(3-Hydroxy-2,2,4-trimethylpentyl)oxy]-1-heptanol | C15H32O3

1-[(3-Hydroxy-2,2,4-trimethylpentyl)oxy]-1-heptanol

  • Molecular FormulaC15H32O3
  • Average mass260.413 Da
  • Monoisotopic mass260.235138 Da
  • ChemSpider ID64882219

More details:

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

1-[(3-Hydroxy-2,2,4-trimethylpentyl)oxy]-1-heptanol [German] [ACD/IUPAC Name]
1-[(3-Hydroxy-2,2,4-trimethylpentyl)oxy]-1-heptanol [ACD/IUPAC Name]
1-[(3-Hydroxy-2,2,4-triméthylpentyl)oxy]-1-heptanol [French] [ACD/IUPAC Name]
1-Heptanol, 1-[(3-hydroxy-2,2,4-trimethylpentyl)oxy]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 335.3±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 156.6±20.9 °C
Index of Refraction: 1.459
Molar Refractivity: 76.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 197.10
ACD/KOC (pH 5.5): 1528.08
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 197.10
ACD/KOC (pH 7.4): 1528.08
Polar Surface Area: 50 Å2
Polarizability: 30.2±0.5 10-24cm3
Surface Tension: 33.3±3.0 dyne/cm
Molar Volume: 278.7±3.0 cm3

Click to predict properties on the Chemicalize site


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