ChemSpider 2D Image | (1S)-1-(2,4-Diethoxyphenyl)ethanol | C12H18O3

(1S)-1-(2,4-Diethoxyphenyl)ethanol

  • Molecular FormulaC12H18O3
  • Average mass210.270 Da
  • Monoisotopic mass210.125595 Da
  • ChemSpider ID32791681

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1S)-1-(2,4-Diethoxyphenyl)ethanol [German] [ACD/IUPAC Name]
(1S)-1-(2,4-Diethoxyphenyl)ethanol [ACD/IUPAC Name]
(1S)-1-(2,4-Diéthoxyphényl)éthanol [French] [ACD/IUPAC Name]
Benzenemethanol, 2,4-diethoxy-α-methyl-, (αS)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 338.0±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.4±3.0 kJ/mol
Flash Point: 158.2±26.5 °C
Index of Refraction: 1.507
Molar Refractivity: 60.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.19
ACD/BCF (pH 5.5): 27.29
ACD/KOC (pH 5.5): 371.08
ACD/LogD (pH 7.4): 2.19
ACD/BCF (pH 7.4): 27.29
ACD/KOC (pH 7.4): 371.08
Polar Surface Area: 39 Å2
Polarizability: 23.8±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 201.5±3.0 cm3

Click to predict properties on the Chemicalize site


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