ChemSpider 2D Image | 2-(3-Bromo-1-propyn-1-yl)-1H-indene | C12H9Br

2-(3-Bromo-1-propyn-1-yl)-1H-indene

  • Molecular FormulaC12H9Br
  • Average mass233.104 Da
  • Monoisotopic mass231.988754 Da
  • ChemSpider ID83804156

More details:

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

1H-Indene, 2-(3-bromo-1-propyn-1-yl)- [ACD/Index Name]
2-(3-Brom-1-propin-1-yl)-1H-inden [German] [ACD/IUPAC Name]
2-(3-Bromo-1-propyn-1-yl)-1H-indene [ACD/IUPAC Name]
2-(3-Bromo-1-propyn-1-yl)-1H-indène [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 315.5±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.5±3.0 kJ/mol
Flash Point: 145.3±22.0 °C
Index of Refraction: 1.647
Molar Refractivity: 57.9±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.22
ACD/LogD (pH 5.5): 4.38
ACD/BCF (pH 5.5): 1247.83
ACD/KOC (pH 5.5): 5725.67
ACD/LogD (pH 7.4): 4.38
ACD/BCF (pH 7.4): 1247.83
ACD/KOC (pH 7.4): 5725.67
Polar Surface Area: 0 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 51.4±5.0 dyne/cm
Molar Volume: 159.4±5.0 cm3

Click to predict properties on the Chemicalize site


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