ChemSpider 2D Image | 2,4,4-Tribromo-5-[(1-hydroxyvinyl)oxy]-1(4H)-naphthalenone | C12H7Br3O3

2,4,4-Tribromo-5-[(1-hydroxyvinyl)oxy]-1(4H)-naphthalenone

  • Molecular FormulaC12H7Br3O3
  • Average mass438.894 Da
  • Monoisotopic mass435.794495 Da
  • ChemSpider ID95681449

More details:

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

1(4H)-Naphthalenone, 2,4,4-tribromo-5-[(1-hydroxyethenyl)oxy]- [ACD/Index Name]
2,4,4-Tribrom-5-[(1-hydroxyvinyl)oxy]-1(4H)-naphthalinon [German] [ACD/IUPAC Name]
2,4,4-Tribromo-5-[(1-hydroxyvinyl)oxy]-1(4H)-naphtalénone [French] [ACD/IUPAC Name]
2,4,4-Tribromo-5-[(1-hydroxyvinyl)oxy]-1(4H)-naphthalenone [ACD/IUPAC Name]

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

Density: 2.2±0.1 g/cm3
Boiling Point: 490.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.8±3.0 kJ/mol
Flash Point: 250.7±28.7 °C
Index of Refraction: 1.721
Molar Refractivity: 78.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 3.80
ACD/BCF (pH 5.5): 458.46
ACD/KOC (pH 5.5): 2795.94
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 448.19
ACD/KOC (pH 7.4): 2733.30
Polar Surface Area: 47 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 71.7±3.0 dyne/cm
Molar Volume: 198.5±3.0 cm3

Click to predict properties on the Chemicalize site


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