ChemSpider 2D Image | 1,7-Dibromo-1,6-heptadiyne | C7H6Br2

1,7-Dibromo-1,6-heptadiyne

  • Molecular FormulaC7H6Br2
  • Average mass249.930 Da
  • Monoisotopic mass247.883606 Da
  • ChemSpider ID74787903

More details:

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

1,6-Heptadiyne, 1,7-dibromo- [ACD/Index Name]
1,7-Dibrom-1,6-heptadiin [German] [ACD/IUPAC Name]
1,7-Dibromo-1,6-heptadiyne [ACD/IUPAC Name]
1,7-Dibromo-1,6-heptadiyne [French] [ACD/IUPAC Name]
1,7-dibromohepta-1,6-diyne
952430-47-6 [RN]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 267.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.5±3.0 kJ/mol
Flash Point: 114.4±24.8 °C
Index of Refraction: 1.585
Molar Refractivity: 46.0±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.39
ACD/LogD (pH 5.5): 4.40
ACD/BCF (pH 5.5): 1310.19
ACD/KOC (pH 5.5): 5929.06
ACD/LogD (pH 7.4): 4.40
ACD/BCF (pH 7.4): 1310.19
ACD/KOC (pH 7.4): 5929.06
Polar Surface Area: 0 Å2
Polarizability: 18.2±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 137.1±3.0 cm3

Click to predict properties on the Chemicalize site


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