ChemSpider 2D Image | (1R,4S)-1,2,3,4-Tetrachlorobicyclo[2.2.1]hepta-2,5-diene | C7H4Cl4

(1R,4S)-1,2,3,4-Tetrachlorobicyclo[2.2.1]hepta-2,5-diene

  • Molecular FormulaC7H4Cl4
  • Average mass229.919 Da
  • Monoisotopic mass227.906708 Da
  • ChemSpider ID75145268
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(1R,4S)-1,2,3,4-Tetrachlorbicyclo[2.2.1]hepta-2,5-dien [German] [ACD/IUPAC Name]
(1R,4S)-1,2,3,4-Tetrachlorobicyclo[2.2.1]hepta-2,5-diene [ACD/IUPAC Name]
(1R,4S)-1,2,3,4-Tétrachlorobicyclo[2.2.1]hepta-2,5-diène [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]hepta-2,5-diene, 1,2,3,4-tetrachloro-, (1R,4S)- [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: 266.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.4±3.0 kJ/mol
Flash Point: 120.0±23.3 °C
Index of Refraction: 1.616
Molar Refractivity: 49.1±0.4 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1134.01
ACD/KOC (pH 5.5): 5346.81
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1134.01
ACD/KOC (pH 7.4): 5346.81
Polar Surface Area: 0 Å2
Polarizability: 19.5±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 140.5±5.0 cm3

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