ChemSpider 2D Image | (2S)-2-(Carboxymethyl)-4,5-dioxotetrahydro-2-furancarboxylic acid | C7H6O7

(2S)-2-(Carboxymethyl)-4,5-dioxotetrahydro-2-furancarboxylic acid

  • Molecular FormulaC7H6O7
  • Average mass202.118 Da
  • Monoisotopic mass202.011353 Da
  • ChemSpider ID61402780

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(Carboxymethyl)-4,5-dioxotetrahydro-2-furancarbonsäure [German] [ACD/IUPAC Name]
(2S)-2-(Carboxymethyl)-4,5-dioxotetrahydro-2-furancarboxylic acid [ACD/IUPAC Name]
2-Furanacetic acid, 2-carboxytetrahydro-4,5-dioxo-, (2S)- [ACD/Index Name]
Acide (2S)-2-(carboxyméthyl)-4,5-dioxotétrahydro-2-furanecarboxylique [French] [ACD/IUPAC Name]
1821717-05-8 [RN]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 654.4±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 105.1±6.0 kJ/mol
Flash Point: 274.3±23.1 °C
Index of Refraction: 1.557
Molar Refractivity: 37.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -1.55
ACD/LogD (pH 5.5): -5.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 86.0±3.0 dyne/cm
Molar Volume: 115.6±3.0 cm3

Click to predict properties on the Chemicalize site


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