ChemSpider 2D Image | 1-Bromo-2-chloro-3-ethynylbenzene | C8H4BrCl

1-Bromo-2-chloro-3-ethynylbenzene

  • Molecular FormulaC8H4BrCl
  • Average mass215.474 Da
  • Monoisotopic mass213.918488 Da
  • ChemSpider ID97243013

More details:

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

1-Brom-2-chlor-3-ethinylbenzol [German] [ACD/IUPAC Name]
1-Bromo-2-chloro-3-ethynylbenzene [ACD/IUPAC Name]
1-Bromo-2-chloro-3-éthynylbenzène [French] [ACD/IUPAC Name]
Benzene, 1-bromo-2-chloro-3-ethynyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 256.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.4±3.0 kJ/mol
Flash Point: 120.1±14.6 °C
Index of Refraction: 1.621
Molar Refractivity: 46.4±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 375.64
ACD/KOC (pH 5.5): 2424.51
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 375.64
ACD/KOC (pH 7.4): 2424.51
Polar Surface Area: 0 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 50.4±5.0 dyne/cm
Molar Volume: 131.9±5.0 cm3

Click to predict properties on the Chemicalize site


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