ChemSpider 2D Image | 3-Bromo-2,4-dioxobutanoic acid | C4H3BrO4

3-Bromo-2,4-dioxobutanoic acid

  • Molecular FormulaC4H3BrO4
  • Average mass194.968 Da
  • Monoisotopic mass193.921463 Da
  • ChemSpider ID60605348

More details:

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

3-Brom-2,4-dioxobutansäure [German] [ACD/IUPAC Name]
3-Bromo-2,4-dioxobutanoic acid [ACD/IUPAC Name]
Acide 3-bromo-2,4-dioxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-bromo-2,4-dioxo- [ACD/Index Name]
56160-82-8 [RN]
MFCD20629334

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

Density: 2.0±0.1 g/cm3
Boiling Point: 236.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 52.1±6.0 kJ/mol
Flash Point: 96.8±24.6 °C
Index of Refraction: 1.531
Molar Refractivity: 30.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.12
ACD/LogD (pH 5.5): -4.92
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 71 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 65.6±3.0 dyne/cm
Molar Volume: 97.2±3.0 cm3

Click to predict properties on the Chemicalize site


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