ChemSpider 2D Image | (1E,3Z)-1-Bromo-1,3-hexadien-5-yne | C6H5Br

(1E,3Z)-1-Bromo-1,3-hexadien-5-yne

  • Molecular FormulaC6H5Br
  • Average mass157.008 Da
  • Monoisotopic mass155.957458 Da
  • ChemSpider ID75600888

  • Double-bond stereo - Double-bond stereo

More details:

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

(1E,3Z)-1-Brom-1,3-hexadien-5-in [German] [ACD/IUPAC Name]
(1E,3Z)-1-Bromo-1,3-hexadien-5-yne [ACD/IUPAC Name]
(1E,3Z)-1-Bromo-1,3-hexadién-5-yne [French] [ACD/IUPAC Name]
1,3-Hexadien-5-yne, 1-bromo-, (1E,3Z)- [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: 142.4±23.0 °C at 760 mmHg
Vapour Pressure: 7.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 36.4±3.0 kJ/mol
Flash Point: 44.2±17.0 °C
Index of Refraction: 1.549
Molar Refractivity: 35.5±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): 2.13
ACD/BCF (pH 5.5): 24.25
ACD/KOC (pH 5.5): 341.00
ACD/LogD (pH 7.4): 2.13
ACD/BCF (pH 7.4): 24.25
ACD/KOC (pH 7.4): 341.00
Polar Surface Area: 0 Å2
Polarizability: 14.1±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 111.8±3.0 cm3

Click to predict properties on the Chemicalize site


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