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Search term: ZCZXOHUILRHRQJ-PWNYCUMCSA-K (Found by InChIKey (full match))
ChemSpider 2D Image | (2R,3R)-2,3-Dihydroxy-4-(phosphonatooxy)butanoate | C4H6O8P

(2R,3R)-2,3-Dihydroxy-4-(phosphonatooxy)butanoate

  • Molecular FormulaC4H6O8P
  • Average mass213.061 Da
  • Monoisotopic mass212.981674 Da
  • ChemSpider ID26331352

  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2,3-Dihydroxy-4-(phosphonatooxy)butanoat [German] [ACD/IUPAC Name]
(2R,3R)-2,3-Dihydroxy-4-(phosphonatooxy)butanoate [ACD/IUPAC Name]
(2R,3R)-2,3-Dihydroxy-4-(phosphonatooxy)butanoate [French] [ACD/IUPAC Name]
Butanoic acid, 2,3-dihydroxy-4-(phosphonooxy)-, ion(3-), (2R,3R)- [ACD/Index Name]
(2R,3R)-2,3-dihydroxy-4-(phosphononatooxy)butanoate
(2R,3R)-2,3-dihydroxy-4-(phosphononatooxy)butanoate; 4-O-phosphonato-D-erythronate
4-O-phosphonato-D-erythronate
4-O-phosphonato-D-erythronate(3-)
4-Phospho-D-erythronate

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

5566997 [DBID]
  • Miscellaneous

    • Chemical Class:

      Trianion of 4-phospho-D-erythronic acid arising from deprotonation of phosphate and carboxylic acid functions. ChEBI CHEBI:58766

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

Density:
Boiling Point: 665.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±6.0 kJ/mol
Flash Point: 356.5±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: -2.54
ACD/LogD (pH 5.5): -7.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.36
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 163 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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