ChemSpider 2D Image | (5-Pentyl-1-benzofuran-2-yl)boronic acid | C13H17BO3

(5-Pentyl-1-benzofuran-2-yl)boronic acid

  • Molecular FormulaC13H17BO3
  • Average mass232.083 Da
  • Monoisotopic mass232.127075 Da
  • ChemSpider ID61007451

More details:

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

(5-Pentyl-1-benzofuran-2-yl)boronic acid [ACD/IUPAC Name]
(5-Pentyl-1-benzofuran-2-yl)borsäure [German] [ACD/IUPAC Name]
Acide (5-pentyl-1-benzofuran-2-yl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(5-pentyl-2-benzofuranyl)- [ACD/Index Name]
331834-08-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 392.4±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.7±3.0 kJ/mol
Flash Point: 191.1±25.7 °C
Index of Refraction: 1.562
Molar Refractivity: 66.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 4.23
ACD/BCF (pH 5.5): 936.75
ACD/KOC (pH 5.5): 4470.79
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 79.39
ACD/KOC (pH 7.4): 378.89
Polar Surface Area: 54 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 44.9±5.0 dyne/cm
Molar Volume: 205.0±5.0 cm3

Click to predict properties on the Chemicalize site


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