ChemSpider 2D Image | (3R)-3-Hydroxy-2-oxobutanoic acid | C4H6O4

(3R)-3-Hydroxy-2-oxobutanoic acid

  • Molecular FormulaC4H6O4
  • Average mass118.088 Da
  • Monoisotopic mass118.026611 Da
  • ChemSpider ID24191945
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(3R)-3-Hydroxy-2-oxobutanoic acid [ACD/IUPAC Name]
(3R)-3-Hydroxy-2-oxobutansäure [German] [ACD/IUPAC Name]
Acide (3R)-3-hydroxy-2-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-hydroxy-2-oxo-, (3R)- [ACD/Index Name]
68862-42-0 [RN]
Butanoic acid, 3-hydroxy-2-oxo-, (R)- (9CI)

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 233.9±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 54.7±6.0 kJ/mol
Flash Point: 109.5±19.1 °C
Index of Refraction: 1.474
Molar Refractivity: 23.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.69
ACD/LogD (pH 5.5): -4.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.91
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 75 Å2
Polarizability: 9.4±0.5 10-24cm3
Surface Tension: 57.9±3.0 dyne/cm
Molar Volume: 84.2±3.0 cm3

Click to predict properties on the Chemicalize site






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