Found 35 results

Search term: MF = 'C_{9}H_{12}O_{7}'
ChemSpider 2D Image | Diethyl (4R,5S)-2-oxo-1,3-dioxolane-4,5-dicarboxylate | C9H12O7

Diethyl (4R,5S)-2-oxo-1,3-dioxolane-4,5-dicarboxylate

  • Molecular FormulaC9H12O7
  • Average mass232.187 Da
  • Monoisotopic mass232.058304 Da
  • ChemSpider ID62811442

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5S)-2-Oxo-1,3-dioxolane-4,5-dicarboxylate de diéthyle [French] [ACD/IUPAC Name]
1,3-Dioxolane-4,5-dicarboxylic acid, 2-oxo-, diethyl ester, (4R,5S)- [ACD/Index Name]
Diethyl (4R,5S)-2-oxo-1,3-dioxolane-4,5-dicarboxylate [ACD/IUPAC Name]
Diethyl-(4R,5S)-2-oxo-1,3-dioxolan-4,5-dicarboxylat [German] [ACD/IUPAC Name]
885604-17-1 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 387.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.7±3.0 kJ/mol
Flash Point: 175.4±27.9 °C
Index of Refraction: 1.463
Molar Refractivity: 48.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.23
ACD/KOC (pH 5.5): 40.28
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.23
ACD/KOC (pH 7.4): 40.28
Polar Surface Area: 88 Å2
Polarizability: 19.2±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 175.5±3.0 cm3

Click to predict properties on the Chemicalize site


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