ChemSpider 2D Image | (1R,4S)-1,2,3,4-Tetrachloro-7,7-dimethoxy-5-phenylbicyclo[2.2.1]hepta-2,5-diene | C15H12Cl4O2

(1R,4S)-1,2,3,4-Tetrachloro-7,7-dimethoxy-5-phenylbicyclo[2.2.1]hepta-2,5-diene

  • Molecular FormulaC15H12Cl4O2
  • Average mass366.067 Da
  • Monoisotopic mass363.959137 Da
  • ChemSpider ID57296010

  • 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-Tetrachlor-7,7-dimethoxy-5-phenylbicyclo[2.2.1]hepta-2,5-dien [German] [ACD/IUPAC Name]
(1R,4S)-1,2,3,4-Tetrachloro-7,7-dimethoxy-5-phenylbicyclo[2.2.1]hepta-2,5-diene [ACD/IUPAC Name]
(1R,4S)-1,2,3,4-Tétrachloro-7,7-diméthoxy-5-phénylbicyclo[2.2.1]hepta-2,5-diène [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]hepta-2,5-diene, 1,2,3,4-tetrachloro-7,7-dimethoxy-5-phenyl-, (1R,4S)- [ACD/Index Name]
1,2,3,4-TETRACHLORO-7,7-DIMETHOXY-5-PHENYL-BICYCLO(2.2.1)HEPTA-2,5-DIENE
1155-77-7 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 396.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.1±3.0 kJ/mol
Flash Point: 132.9±28.0 °C
Index of Refraction: 1.620
Molar Refractivity: 86.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 5.78
ACD/BCF (pH 5.5): 14535.21
ACD/KOC (pH 5.5): 33193.19
ACD/LogD (pH 7.4): 5.78
ACD/BCF (pH 7.4): 14535.21
ACD/KOC (pH 7.4): 33193.19
Polar Surface Area: 18 Å2
Polarizability: 34.2±0.5 10-24cm3
Surface Tension: 50.3±5.0 dyne/cm
Molar Volume: 245.8±5.0 cm3

Click to predict properties on the Chemicalize site


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