ChemSpider 2D Image | (2R,3S)-2-Methyl-2,3-oxiranedicarboxylic acid | C5H6O5

(2R,3S)-2-Methyl-2,3-oxiranedicarboxylic acid

  • Molecular FormulaC5H6O5
  • Average mass146.098 Da
  • Monoisotopic mass146.021530 Da
  • ChemSpider ID29779866

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2R,3S)-2-Methyl-2,3-oxirandicarbonsäure [German] [ACD/IUPAC Name]
(2R,3S)-2-Methyl-2,3-oxiranedicarboxylic acid [ACD/IUPAC Name]
2,3-Oxiranedicarboxylic acid, 2-methyl-, (2R,3S)- [ACD/Index Name]
Acide (2R,3S)-2-méthyl-2,3-oxiranedicarboxylique [French] [ACD/IUPAC Name]
(2R,3S)-2-methyloxirane-2,3-dicarboxylic acid
159464-64-9 [RN]
2,3-Oxiranedicarboxylicacid,2-methyl-,(2R,3S)-rel-(9CI)

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

Density: 1.7±0.1 g/cm3
Boiling Point: 399.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.4±6.0 kJ/mol
Flash Point: 180.6±21.4 °C
Index of Refraction: 1.547
Molar Refractivity: 27.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.71
ACD/LogD (pH 5.5): -4.18
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 87 Å2
Polarizability: 11.0±0.5 10-24cm3
Surface Tension: 78.5±3.0 dyne/cm
Molar Volume: 87.2±3.0 cm3

Click to predict properties on the Chemicalize site


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