ChemSpider 2D Image | (5S)-5-Hydroxy-2,4-dioxohexanoate | C6H7O5

(5S)-5-Hydroxy-2,4-dioxohexanoate

  • Molecular FormulaC6H7O5
  • Average mass159.117 Da
  • Monoisotopic mass159.029892 Da
  • ChemSpider ID58170190

  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-5-Hydroxy-2,4-dioxohexanoat [German] [ACD/IUPAC Name]
(5S)-5-Hydroxy-2,4-dioxohexanoate [ACD/IUPAC Name]
(5S)-5-Hydroxy-2,4-dioxohexanoate [French] [ACD/IUPAC Name]
Hexanoic acid, 5-hydroxy-2,4-dioxo-, ion(1-), (5S)- [ACD/Index Name]
2,4-didehydro-3-deoxy-L-rhamnonate
L-2,4-diketo-3-deoxyrhamnonate
  • Miscellaneous

    • Chemical Class:

      A carbohydrate acid anion that is the conjugate base of 2,4-didehydro-3-deoxy-L-rhamnonic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. ChEBI CHEBI:131847

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

Density:
Boiling Point: 311.4±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.0±6.0 kJ/mol
Flash Point: 156.4±18.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -1.22
ACD/LogD (pH 5.5): -4.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 95 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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