ChemSpider 2D Image | 1-Bromo-2-[(1E)-1-octen-3-yn-1-yl]benzene | C14H15Br

1-Bromo-2-[(1E)-1-octen-3-yn-1-yl]benzene

  • Molecular FormulaC14H15Br
  • Average mass263.173 Da
  • Monoisotopic mass262.035706 Da
  • ChemSpider ID35806887

  • Double-bond stereo - Double-bond stereo

More details:

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

1-Brom-2-[(1E)-1-octen-3-in-1-yl]benzol [German] [ACD/IUPAC Name]
1-Bromo-2-[(1E)-1-octen-3-yn-1-yl]benzene [ACD/IUPAC Name]
1-Bromo-2-[(1E)-1-octén-3-yn-1-yl]benzène [French] [ACD/IUPAC Name]
Benzene, 1-bromo-2-[(1E)-1-octen-3-yn-1-yl]- [ACD/Index Name]
BENZENE, 1-BROMO-2-(1Z)-1-OCTEN-3-YNYL-

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

Density: 1.2±0.1 g/cm3
Boiling Point: 338.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.9±3.0 kJ/mol
Flash Point: 155.4±17.6 °C
Index of Refraction: 1.583
Molar Refractivity: 71.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.47
ACD/LogD (pH 5.5): 5.43
ACD/BCF (pH 5.5): 7930.58
ACD/KOC (pH 5.5): 21513.58
ACD/LogD (pH 7.4): 5.43
ACD/BCF (pH 7.4): 7930.58
ACD/KOC (pH 7.4): 21513.58
Polar Surface Area: 0 Å2
Polarizability: 28.1±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 212.4±3.0 cm3

Click to predict properties on the Chemicalize site


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