ChemSpider 2D Image | (2S,3R)-3-Hydroxy(4-~13~C,2,4-~2~H_2_)butanoic acid | C313CH6D2O3

(2S,3R)-3-Hydroxy(4-13C,2,4-2H2)butanoic acid

  • Molecular FormulaC313CH6D2O3
  • Average mass107.109 Da
  • Monoisotopic mass107.063255 Da
  • ChemSpider ID26581097
  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S,3R)-3-Hydroxy(4-13C,2,4-2H2)butanoic acid [ACD/IUPAC Name]
(2S,3R)-3-Hydroxy(4-13C,2,4-2H2)butansäure [German] [ACD/IUPAC Name]
Acide (2S,3R)-3-hydroxy(4-13C,2,4-2H2)butanoïque [French] [ACD/IUPAC Name]
Butanoic-4-13C-2,4-d2 acid, 3-hydroxy-, (2S,3R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.455
Molar Refractivity: 23.6±0.3 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 9.4±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 87.1±3.0 cm3

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