ChemSpider 2D Image | (3S)-3,4-Dihydroxy-2-oxobutanoate | C4H5O5

(3S)-3,4-Dihydroxy-2-oxobutanoate

  • Molecular FormulaC4H5O5
  • Average mass133.080 Da
  • Monoisotopic mass133.014252 Da
  • ChemSpider ID76962896

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3,4-Dihydroxy-2-oxobutanoat [German] [ACD/IUPAC Name]
(3S)-3,4-Dihydroxy-2-oxobutanoate [ACD/IUPAC Name]
(3S)-3,4-Dihydroxy-2-oxobutanoate [French] [ACD/IUPAC Name]
Butanoic acid, 3,4-dihydroxy-2-oxo-, ion(1-), (3S)- [ACD/Index Name]
(S)-3,4-dihydroxy-2-oxobutanoate

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

Density:
Boiling Point: 367.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.0±6.0 kJ/mol
Flash Point: 190.0±21.6 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.34
ACD/LogD (pH 5.5): -5.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.60
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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