ChemSpider 2D Image | (2E)-2-Bromo-3-hydroxy-2-butenedial | C4H3BrO3

(2E)-2-Bromo-3-hydroxy-2-butenedial

  • Molecular FormulaC4H3BrO3
  • Average mass178.969 Da
  • Monoisotopic mass177.926544 Da
  • ChemSpider ID61354965

More details:

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

(2E)-2-Brom-3-hydroxy-2-butendial [German] [ACD/IUPAC Name]
(2E)-2-Bromo-3-hydroxy-2-butenedial [ACD/IUPAC Name]
(2E)-2-Bromo-3-hydroxy-2-butènedial [French] [ACD/IUPAC Name]
2-Butenedial, 2-bromo-3-hydroxy-, (2E)- [ACD/Index Name]
855234-75-2 [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: 303.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 63.1±6.0 kJ/mol
Flash Point: 137.5±27.9 °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: -0.54
ACD/LogD (pH 5.5): -0.42
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 13.81
ACD/LogD (pH 7.4): -0.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.73
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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