ChemSpider 2D Image | (4S,7R)-7-Ethyl-2-methyl-4-undecanol | C14H30O

(4S,7R)-7-Ethyl-2-methyl-4-undecanol

  • Molecular FormulaC14H30O
  • Average mass214.387 Da
  • Monoisotopic mass214.229660 Da
  • ChemSpider ID32786900
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(4S,7R)-7-Ethyl-2-methyl-4-undecanol [German] [ACD/IUPAC Name]
(4S,7R)-7-Ethyl-2-methyl-4-undecanol [ACD/IUPAC Name]
(4S,7R)-7-Éthyl-2-méthyl-4-undécanol [French] [ACD/IUPAC Name]
4-Undecanol, 7-ethyl-2-methyl-, (4S,7R)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.8±0.1 g/cm3
Boiling Point: 264.2±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 58.3±6.0 kJ/mol
Flash Point: 114.9±8.6 °C
Index of Refraction: 1.442
Molar Refractivity: 68.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 4.82
ACD/BCF (pH 5.5): 2724.59
ACD/KOC (pH 5.5): 10013.45
ACD/LogD (pH 7.4): 4.82
ACD/BCF (pH 7.4): 2724.59
ACD/KOC (pH 7.4): 10013.45
Polar Surface Area: 20 Å2
Polarizability: 27.1±0.5 10-24cm3
Surface Tension: 28.7±3.0 dyne/cm
Molar Volume: 258.3±3.0 cm3

Click to predict properties on the Chemicalize site






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