ChemSpider 2D Image | (2S,3R)-4-Amino-2,3-dihydroxy-4-oxobutanoic acid | C4H7NO5

(2S,3R)-4-Amino-2,3-dihydroxy-4-oxobutanoic acid

  • Molecular FormulaC4H7NO5
  • Average mass149.102 Da
  • Monoisotopic mass149.032425 Da
  • ChemSpider ID32980494

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R)-4-Amino-2,3-dihydroxy-4-oxobutanoic acid [ACD/IUPAC Name]
(2S,3R)-4-Amino-2,3-dihydroxy-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide (2S,3R)-4-amino-2,3-dihydroxy-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 4-amino-2,3-dihydroxy-4-oxo-, (2S,3R)- [ACD/Index Name]
1354379-99-9 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 554.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.4 mmHg at 25°C
Enthalpy of Vaporization: 96.1±6.0 kJ/mol
Flash Point: 289.3±30.1 °C
Index of Refraction: 1.584
Molar Refractivity: 28.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -1.84
ACD/LogD (pH 5.5): -4.54
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 121 Å2
Polarizability: 11.4±0.5 10-24cm3
Surface Tension: 106.4±3.0 dyne/cm
Molar Volume: 85.8±3.0 cm3

Click to predict properties on the Chemicalize site


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