ChemSpider 2D Image | [(3E)-4-Bromo-3-buten-1-yn-1-yl]benzene | C10H7Br

[(3E)-4-Bromo-3-buten-1-yn-1-yl]benzene

  • Molecular FormulaC10H7Br
  • Average mass207.067 Da
  • Monoisotopic mass205.973099 Da
  • ChemSpider ID96274953

  • Double-bond stereo - Double-bond stereo

More details:

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

[(3E)-4-Brom-3-buten-1-in-1-yl]benzol [German] [ACD/IUPAC Name]
[(3E)-4-Bromo-3-buten-1-yn-1-yl]benzene [ACD/IUPAC Name]
[(3E)-4-Bromo-3-butén-1-yn-1-yl]benzène [French] [ACD/IUPAC Name]
Benzene, [(3E)-4-bromo-3-buten-1-yn-1-yl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 239.1±32.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.7±3.0 kJ/mol
Flash Point: 99.6±19.5 °C
Index of Refraction: 1.615
Molar Refractivity: 50.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.01
ACD/LogD (pH 5.5): 4.00
ACD/BCF (pH 5.5): 648.26
ACD/KOC (pH 5.5): 3583.06
ACD/LogD (pH 7.4): 4.00
ACD/BCF (pH 7.4): 648.26
ACD/KOC (pH 7.4): 3583.06
Polar Surface Area: 0 Å2
Polarizability: 20.2±0.5 10-24cm3
Surface Tension: 46.8±5.0 dyne/cm
Molar Volume: 145.9±5.0 cm3

Click to predict properties on the Chemicalize site


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