ChemSpider 2D Image | (3R)-3-Hydroxy-2-oxo-4-(phosphonatooxy)butanoate | C4H4O8P


  • Molecular FormulaC4H4O8P
  • Average mass211.045 Da
  • Monoisotopic mass210.966019 Da
  • ChemSpider ID26331226
  • Charge - Charge

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3R)-3-Hydroxy-2-oxo-4-(phosphonatooxy)butanoat [German] [ACD/IUPAC Name]
(3R)-3-Hydroxy-2-oxo-4-(phosphonatooxy)butanoate [ACD/IUPAC Name]
(3R)-3-Hydroxy-2-oxo-4-(phosphonatooxy)butanoate [French] [ACD/IUPAC Name]
Butanoic acid, 3-hydroxy-2-oxo-4-(phosphonooxy)-, ion(3-), (3R)- [ACD/Index Name]
(3R)-3-hydroxy-2-oxo-4 phosphonooxybutanoate
  • Miscellaneous
    • Chemical Class:

      Trianion of (R)-3-hydroxy-2-oxo-4-phosphonooxybutanoic acid arising from deprotonation of both the carboxyl and phosphate functions. ChEBI CHEBI:58538

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

Boiling Point: 514.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.5±6.0 kJ/mol
Flash Point: 265.1±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -2.87
ACD/LogD (pH 5.5): -7.69
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 160 Å2
Surface Tension:
Molar Volume:

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