ChemSpider 2D Image | (2R,3S)-2-Ammonio-3-hydroxysuccinate | C4H6NO5

(2R,3S)-2-Ammonio-3-hydroxysuccinate

  • Molecular FormulaC4H6NO5
  • Average mass148.095 Da
  • Monoisotopic mass148.025146 Da
  • ChemSpider ID26332032
  • Charge - Charge

    defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2R,3S)-2-Ammonio-3-hydroxysuccinat [German] [ACD/IUPAC Name]
(2R,3S)-2-Ammonio-3-hydroxysuccinate [ACD/IUPAC Name]
(2R,3S)-2-Ammonio-3-hydroxysuccinate [French] [ACD/IUPAC Name]
D-Aspartic acid, 3-hydroxy-, inner salt, ion(1-), (3S)- [ACD/Index Name]
(2R,3S)-2-ammonio-3-hydroxybutanedioate
(3S)-3-hydroxy-D-aspartate
(3S)-3-hydroxy-D-aspartate(1-)
D-erythro-3-hydroxyaspartate
erythro-3-hydroxy-D-aspartate
erythro-β-hydroxy-D-aspartate
  • Miscellaneous
    • Chemical Class:

      A D-alpha-amino acid anion which is obtained from (3S)-3-hydroxy-D-aspartic acid by formal deprotonation of both carboxyl groups and; protonation of the amino group. ChEBI CHEBI:60894

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

Density:
Boiling Point: 368.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 71.2±6.0 kJ/mol
Flash Point: 176.8±27.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.51
ACD/LogD (pH 5.5): -4.58
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 128 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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