ChemSpider 2D Image | [(1E)-4-Chloro-1-buten-3-yn-1-yl]benzene | C10H7Cl

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

  • Molecular FormulaC10H7Cl
  • Average mass162.616 Da
  • Monoisotopic mass162.023621 Da
  • ChemSpider ID74070484

  • Double-bond stereo - Double-bond stereo

More details:

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

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 239.3±19.0 °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: 150.1±17.1 °C
Index of Refraction: 1.618
Molar Refractivity: 49.6±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.11
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1169.68
ACD/KOC (pH 5.5): 5466.65
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1169.68
ACD/KOC (pH 7.4): 5466.65
Polar Surface Area: 0 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 141.6±3.0 cm3

Click to predict properties on the Chemicalize site


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