ChemSpider 2D Image | Alcohol, 2-ethylhexyl | C8H18O

Alcohol, 2-ethylhexyl

  • Molecular FormulaC8H18O
  • Average mass130.228 Da
  • Monoisotopic mass130.135757 Da
  • ChemSpider ID18556213

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Methyl-1-heptanol [German] [ACD/IUPAC Name]
(3S)-3-Methyl-1-heptanol [ACD/IUPAC Name]
(3S)-3-Méthyl-1-heptanol [French] [ACD/IUPAC Name]
1-Heptanol, 3-methyl-, (3S)- [ACD/Index Name]
Alcohol, 2-ethylhexyl
(3S)-3-methylheptan-1-ol
(S)-3-METHYL-1-HEPTANOL
1070-32-2 [RN]
248-133-5 [EINECS]
26952-21-6 [RN]
More...

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

Density: 0.8±0.0 g/cm3
Boiling Point: 179.2±0.0 °C at 760 mmHg
Vapour Pressure: 0.3±0.0 mmHg at 25°C
Enthalpy of Vaporization: 48.4±0.0 kJ/mol
Flash Point: 71.1±0.0 °C
Index of Refraction: 1.426
Molar Refractivity: 40.6±0.0 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 2.72
ACD/BCF (pH 5.5): 68.81
ACD/KOC (pH 5.5): 719.45
ACD/LogD (pH 7.4): 2.72
ACD/BCF (pH 7.4): 68.81
ACD/KOC (pH 7.4): 719.45
Polar Surface Area: 20 Å2
Polarizability: 16.1±0.0 10-24cm3
Surface Tension: 28.0±0.0 dyne/cm
Molar Volume: 158.5±0.0 cm3

Click to predict properties on the Chemicalize site


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