ChemSpider 2D Image | 5-[Bromo(cyclooctyl)methyl]-2,2-dimethyl-2,3-dihydro-1-benzofuran | C19H27BrO

5-[Bromo(cyclooctyl)methyl]-2,2-dimethyl-2,3-dihydro-1-benzofuran

  • Molecular FormulaC19H27BrO
  • Average mass351.321 Da
  • Monoisotopic mass350.124512 Da
  • ChemSpider ID48331832

More details:

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

5-[Brom(cyclooctyl)methyl]-2,2-dimethyl-2,3-dihydro-1-benzofuran [German] [ACD/IUPAC Name]
5-[Bromo(cyclooctyl)methyl]-2,2-dimethyl-2,3-dihydro-1-benzofuran [ACD/IUPAC Name]
5-[Bromo(cyclooctyl)méthyl]-2,2-diméthyl-2,3-dihydro-1-benzofurane [French] [ACD/IUPAC Name]
Benzofuran, 5-(bromocyclooctylmethyl)-2,3-dihydro-2,2-dimethyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 414.6±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.2±3.0 kJ/mol
Flash Point: 160.2±24.0 °C
Index of Refraction: 1.543
Molar Refractivity: 92.3±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.41
ACD/LogD (pH 5.5): 6.72
ACD/BCF (pH 5.5): 75082.77
ACD/KOC (pH 5.5): 107520.62
ACD/LogD (pH 7.4): 6.72
ACD/BCF (pH 7.4): 75082.77
ACD/KOC (pH 7.4): 107520.62
Polar Surface Area: 9 Å2
Polarizability: 36.6±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 292.7±3.0 cm3

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