ChemSpider 2D Image | 5-Chloro-2',5'-dimethoxy-3H,4'H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-3,4'-dione | C15H11ClO5

5-Chloro-2',5'-dimethoxy-3H,4'H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-3,4'-dione

  • Molecular FormulaC15H11ClO5
  • Average mass306.698 Da
  • Monoisotopic mass306.029510 Da
  • ChemSpider ID28483420

More details:

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

5-Chloro-2',5'-dimethoxy-3H,4'H-spiro[1-benzofuran-2,1'-cyclohexa[2,5]diene]-3,4'-dione [ACD/IUPAC Name]
Spiro[benzofuran-2(3H),1'-cyclohexa[2,5]diene]-3,4'-dione, 5-chloro-2',5'-dimethoxy- [ACD/Index 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: 564.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.8±3.0 kJ/mol
Flash Point: 241.1±29.1 °C
Index of Refraction: 1.622
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.10
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 58.15
ACD/KOC (pH 5.5): 637.78
ACD/LogD (pH 7.4): 2.62
ACD/BCF (pH 7.4): 58.15
ACD/KOC (pH 7.4): 637.78
Polar Surface Area: 62 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 210.1±5.0 cm3

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