ChemSpider 2D Image | (2R,3R)-3-Hydroxy-2-(phosphonooxy)butanoic acid | C4H9O7P

(2R,3R)-3-Hydroxy-2-(phosphonooxy)butanoic acid

  • Molecular FormulaC4H9O7P
  • Average mass200.084 Da
  • Monoisotopic mass200.008591 Da
  • ChemSpider ID75141899

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-3-Hydroxy-2-(phosphonooxy)butanoic acid [ACD/IUPAC Name]
(2R,3R)-3-Hydroxy-2-(phosphonooxy)butansäure [German] [ACD/IUPAC Name]
Acide (2R,3R)-3-hydroxy-2-(phosphonooxy)butanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 3-hydroxy-2-(phosphonooxy)-, (2R,3R)- [ACD/Index Name]

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

Density: 1.8±0.1 g/cm3
Boiling Point: 487.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.8±6.0 kJ/mol
Flash Point: 248.7±31.5 °C
Index of Refraction: 1.537
Molar Refractivity: 35.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -2.14
ACD/LogD (pH 5.5): -6.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 134 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 92.0±3.0 dyne/cm
Molar Volume: 113.0±3.0 cm3

Click to predict properties on the Chemicalize site


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