ChemSpider 2D Image | 5'-Bromo-5-methoxy-3H,3'H-2,2'-spirobi[[1]benzofuran]-3-one | C16H11BrO4

5'-Bromo-5-methoxy-3H,3'H-2,2'-spirobi[[1]benzofuran]-3-one

  • Molecular FormulaC16H11BrO4
  • Average mass347.160 Da
  • Monoisotopic mass345.984070 Da
  • ChemSpider ID29327416

More details:

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

2,2'(3H,3'H)-Spirobi[benzofuran]-3-one, 5'-bromo-5-methoxy- [ACD/Index Name]
5'-Bromo-5-methoxy-3H,3'H-2,2'-spirobi[[1]benzofuran]-3-one [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 506.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.7±3.0 kJ/mol
Flash Point: 260.3±30.1 °C
Index of Refraction: 1.693
Molar Refractivity: 78.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 3.81
ACD/BCF (pH 5.5): 458.78
ACD/KOC (pH 5.5): 2797.58
ACD/LogD (pH 7.4): 3.81
ACD/BCF (pH 7.4): 458.78
ACD/KOC (pH 7.4): 2797.58
Polar Surface Area: 45 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 66.1±5.0 dyne/cm
Molar Volume: 205.8±5.0 cm3

Click to predict properties on the Chemicalize site


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