ChemSpider 2D Image | (2S)-2,4-Dibromobutanoic acid | C4H6Br2O2

(2S)-2,4-Dibromobutanoic acid

  • Molecular FormulaC4H6Br2O2
  • Average mass245.897 Da
  • Monoisotopic mass243.873444 Da
  • ChemSpider ID113059583

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2,4-Dibrombutansäure [German] [ACD/IUPAC Name]
(2S)-2,4-Dibromobutanoic acid [ACD/IUPAC Name]
Acide (2S)-2,4-dibromobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2,4-dibromo-, (2S)- [ACD/Index Name]

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

Density: 2.1±0.1 g/cm3
Boiling Point: 294.1±25.0 °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±23.2 °C
Index of Refraction: 1.561
Molar Refractivity: 37.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.10
ACD/LogD (pH 5.5): -1.12
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 37 Å2
Polarizability: 14.9±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 115.9±3.0 cm3

Click to predict properties on the Chemicalize site


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