ChemSpider 2D Image | 2-Butyl(~2~H_5_)-1-benzofuran | C12H9D5O

2-Butyl(2H5)-1-benzofuran

  • Molecular FormulaC12H9D5O
  • Average mass179.270 Da
  • Monoisotopic mass179.135849 Da
  • ChemSpider ID8686959

  • Non-standard isotope - Non-standard isotope

More details:

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

2-Butyl(2H5)-1-benzofuran [ACD/IUPAC Name]
2-Butyl(2H5)-1-benzofuran [German] [ACD/IUPAC Name]
2-Butyl(2H5)-1-benzofurane [French] [ACD/IUPAC Name]
Benzofuran-3,4,5,6,7-d5, 2-butyl- [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: 248.1±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 46.6±3.0 kJ/mol
Flash Point: 101.1±0.0 °C
Index of Refraction: 1.554
Molar Refractivity: 55.2±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1535.49
ACD/KOC (pH 5.5): 6642.22
ACD/LogD (pH 7.4): 4.49
ACD/BCF (pH 7.4): 1535.49
ACD/KOC (pH 7.4): 6642.22
Polar Surface Area: 13 Å2
Polarizability: 21.9±0.5 10-24cm3
Surface Tension: 35.8±3.0 dyne/cm
Molar Volume: 172.2±3.0 cm3

Click to predict properties on the Chemicalize site


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