ChemSpider 2D Image | 2-Ethyl-2-[(2-~2~H)phenyl]-1-butanol | C12H17DO

2-Ethyl-2-[(2-2H)phenyl]-1-butanol

  • Molecular FormulaC12H17DO
  • Average mass179.277 Da
  • Monoisotopic mass179.142044 Da
  • ChemSpider ID13088880

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Ethyl-2-[(2-2H)phenyl]-1-butanol [ACD/IUPAC Name]
2-Ethyl-2-[(2-2H)phenyl]-1-butanol [German] [ACD/IUPAC Name]
2-Éthyl-2-[(2-2H)phényl]-1-butanol [French] [ACD/IUPAC Name]
Benzene-2-d-ethanol, β,β-diethyl- [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: 237.1±8.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.1±3.0 kJ/mol
Flash Point: 104.2±8.9 °C
Index of Refraction: 1.506
Molar Refractivity: 55.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.12
ACD/LogD (pH 5.5): 3.11
ACD/BCF (pH 5.5): 136.92
ACD/KOC (pH 5.5): 1177.33
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.92
ACD/KOC (pH 7.4): 1177.33
Polar Surface Area: 20 Å2
Polarizability: 22.0±0.5 10-24cm3
Surface Tension: 34.3±3.0 dyne/cm
Molar Volume: 186.6±3.0 cm3

Click to predict properties on the Chemicalize site


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