ChemSpider 2D Image | (2R,3R)-2,3,4-Trihydroxy-2-(~2~H_1_)methylbutanoic acid | C5H9DO5

(2R,3R)-2,3,4-Trihydroxy-2-(2H1)methylbutanoic acid

  • Molecular FormulaC5H9DO5
  • Average mass151.136 Da
  • Monoisotopic mass151.059097 Da
  • ChemSpider ID67177880

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2R,3R)-2,3,4-Trihydroxy-2-(2H1)methylbutanoic acid [ACD/IUPAC Name]
(2R,3R)-2,3,4-Trihydroxy-2-(2H1)methylbutansäure [German] [ACD/IUPAC Name]
Acide (2R,3R)-2,3,4-trihydroxy-2-(2H1)méthylbutanoïque [French] [ACD/IUPAC Name]
Butanoic acid, 2,3,4-trihydroxy-2-(methyl-d)-, (2R,3R)- [ACD/Index Name]
2-c-methyl-d-erythronic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 473.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 84.9±6.0 kJ/mol
Flash Point: 254.3±25.2 °C
Index of Refraction: 1.548
Molar Refractivity: 31.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.67
ACD/LogD (pH 5.5): -3.94
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 98 Å2
Polarizability: 12.4±0.5 10-24cm3
Surface Tension: 80.6±3.0 dyne/cm
Molar Volume: 98.6±3.0 cm3

Click to predict properties on the Chemicalize site


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