ChemSpider 2D Image | (2Z)-2-Bromo-4-oxo-2-butenoic acid | C4H3BrO3

(2Z)-2-Bromo-4-oxo-2-butenoic acid

  • Molecular FormulaC4H3BrO3
  • Average mass178.969 Da
  • Monoisotopic mass177.926544 Da
  • ChemSpider ID61083219

More details:

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

(2Z)-2-Brom-4-oxo-2-butensäure [German] [ACD/IUPAC Name]
(2Z)-2-Bromo-4-oxo-2-butenoic acid [ACD/IUPAC Name]
2-Butenoic acid, 2-bromo-4-oxo-, (2Z)- [ACD/Index Name]
Acide (2Z)-2-bromo-4-oxo-2-buténoïque [French] [ACD/IUPAC Name]
70828-15-8 [RN]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 294.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 58.7±6.0 kJ/mol
Flash Point: 131.6±25.9 °C
Index of Refraction: 1.557
Molar Refractivity: 30.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.02
ACD/LogD (pH 5.5): -3.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 54 Å2
Polarizability: 11.9±0.5 10-24cm3
Surface Tension: 58.5±3.0 dyne/cm
Molar Volume: 93.1±3.0 cm3

Click to predict properties on the Chemicalize site


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