ChemSpider 2D Image | Dimethyl 2,3-dihydroxy-2-butenedioate | C6H8O6

Dimethyl 2,3-dihydroxy-2-butenedioate

  • Molecular FormulaC6H8O6
  • Average mass176.124 Da
  • Monoisotopic mass176.032089 Da
  • ChemSpider ID26467953

More details:

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

133-47-1 [RN]
2,3-Dihydroxy-2-butènedioate de diméthyle [French] [ACD/IUPAC Name]
2-Butenedioic acid, 2,3-dihydroxy-, dimethyl ester [ACD/Index Name]
Dihydroxyfumaric acid dimethyl ester
dimethyl 2,3-dihydroxy-2-butenedioate [ACD/IUPAC Name]
Dimethyl-2,3-dihydroxy-2-butendioat [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 304.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 63.1±6.0 kJ/mol
Flash Point: 126.4±21.4 °C
Index of Refraction: 1.502
Molar Refractivity: 36.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.68
ACD/LogD (pH 5.5): -0.68
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.20
ACD/LogD (pH 7.4): -0.68
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.12
Polar Surface Area: 93 Å2
Polarizability: 14.4±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 122.8±3.0 cm3

Click to predict properties on the Chemicalize site


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