ChemSpider 2D Image | Diethyl (2,5-dioxocyclopentyl)(hydroxy)malonate | C12H16O7

Diethyl (2,5-dioxocyclopentyl)(hydroxy)malonate

  • Molecular FormulaC12H16O7
  • Average mass272.251 Da
  • Monoisotopic mass272.089600 Da
  • ChemSpider ID28674051

More details:

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

(2,5-Dioxocyclopentyl)(hydroxy)malonate de diéthyle [French] [ACD/IUPAC Name]
1,3-Diethyl 2-(2,5-dioxocyclopentyl)-2-hydroxypropanedioate
113443-97-3 [RN]
Diethyl (2,5-dioxocyclopentyl)(hydroxy)malonate [ACD/IUPAC Name]
Diethyl-(2,5-dioxocyclopentyl)(hydroxy)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(2,5-dioxocyclopentyl)-2-hydroxy-, diethyl ester [ACD/Index Name]
Diethyl (2,5-dioxocyclopentyl)(hydroxy)propanedioate
PROPANEDIOIC ACID, (2,5-DIOXOCYCLOPENTYL)HYDROXY-, DIETHYL ESTER

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

Density: 1.3±0.1 g/cm3
Boiling Point: 426.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±6.0 kJ/mol
Flash Point: 160.7±20.8 °C
Index of Refraction: 1.511
Molar Refractivity: 60.5±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 2.08
ACD/KOC (pH 5.5): 58.65
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.33
ACD/KOC (pH 7.4): 37.64
Polar Surface Area: 107 Å2
Polarizability: 24.0±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 201.9±3.0 cm3

Click to predict properties on the Chemicalize site


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