ChemSpider 2D Image | TBCA | C9H4Br4O2

TBCA

  • Molecular FormulaC9H4Br4O2
  • Average mass463.743 Da
  • Monoisotopic mass459.694458 Da
  • ChemSpider ID52563948

More details:

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

2-Propenoic acid, 3-(2,3,4,5-tetrabromophenyl)- [ACD/Index Name]
3-(2,3,4,5-tetrabromophenyl)acrylic acid [ACD/IUPAC Name]
3-(2,3,4,5-Tetrabromphenyl)acrylsäure [German] [ACD/IUPAC Name]
934358-00-6 [RN]
Acide 3-(2,3,4,5-tétrabromophényl)acrylique [French] [ACD/IUPAC Name]
TBCA
3-(2,3,4,5-Tetrabromophenyl)prop-2-enoic acid

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

Density: 2.4±0.1 g/cm3
Boiling Point: 490.8±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: 250.6±28.7 °C
Index of Refraction: 1.714
Molar Refractivity: 74.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 59.08
ACD/KOC (pH 5.5): 215.37
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 4.56
Polar Surface Area: 37 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 62.7±3.0 dyne/cm
Molar Volume: 189.8±3.0 cm3

Click to predict properties on the Chemicalize site


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