ChemSpider 2D Image | (2R,3R)-2,3-Dihydroxy-4-isopropoxy-4-oxobutanoic acid | C7H12O6

(2R,3R)-2,3-Dihydroxy-4-isopropoxy-4-oxobutanoic acid

  • Molecular FormulaC7H12O6
  • Average mass192.167 Da
  • Monoisotopic mass192.063385 Da
  • ChemSpider ID48062068

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3R)-2,3-Dihydroxy-4-isopropoxy-4-oxobutanoic acid [ACD/IUPAC Name]
(2R,3R)-2,3-Dihydroxy-4-isopropoxy-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide (2R,3R)-2,3-dihydroxy-4-isopropoxy-4-oxobutanoïque [French] [ACD/IUPAC Name]
Butanedioic acid, 2,3-dihydroxy-, mono(1-methylethyl) ester, (2R,3R)- [ACD/Index Name]
(2R,3R)-2,3-Dihydroxy-4-oxo-4-[(propan-2-yl)oxy]butanoic acid
(2R,3R)-2,3-dihydroxy-4-oxo-4-propan-2-yloxybutanoic acid
116601-09-3 [RN]
Isopropyl tartaric acid
Tartaric Acid Isopropyl Ester

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

Density: 1.4±0.1 g/cm3
Boiling Point: 423.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.3±6.0 kJ/mol
Flash Point: 175.6±22.2 °C
Index of Refraction: 1.501
Molar Refractivity: 40.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -3.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 104 Å2
Polarizability: 16.2±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 138.3±3.0 cm3

Click to predict properties on the Chemicalize site


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