ChemSpider 2D Image | (2Z)-3-Bromo-4-hydroxy-2-butenoic acid | C4H5BrO3

(2Z)-3-Bromo-4-hydroxy-2-butenoic acid

  • Molecular FormulaC4H5BrO3
  • Average mass180.985 Da
  • Monoisotopic mass179.942200 Da
  • ChemSpider ID61227092

More details:

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

(2Z)-3-Brom-4-hydroxy-2-butensäure [German] [ACD/IUPAC Name]
(2Z)-3-Bromo-4-hydroxy-2-butenoic acid [ACD/IUPAC Name]
2-Butenoic acid, 3-bromo-4-hydroxy-, (2Z)- [ACD/Index Name]
Acide (2Z)-3-bromo-4-hydroxy-2-buténoïque [French] [ACD/IUPAC Name]
859925-09-0 [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: 358.8±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 70.0±6.0 kJ/mol
Flash Point: 170.8±26.5 °C
Index of Refraction: 1.586
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.83
ACD/LogD (pH 5.5): -1.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 58 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 65.5±3.0 dyne/cm
Molar Volume: 93.3±3.0 cm3

Click to predict properties on the Chemicalize site


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