ChemSpider 2D Image | Diethyl (~2~H_5_)ethyl(3-phenoxypropyl)malonate | C18H21D5O5

Diethyl (2H5)ethyl(3-phenoxypropyl)malonate

  • Molecular FormulaC18H21D5O5
  • Average mass327.427 Da
  • Monoisotopic mass327.209412 Da
  • ChemSpider ID8149325

  • Non-standard isotope - Non-standard isotope

More details:

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

(2H5)Éthyl(3-phénoxypropyl)malonate de diéthyle [French] [ACD/IUPAC Name]
Diethyl (2H5)ethyl(3-phenoxypropyl)malonate [ACD/IUPAC Name]
Diethyl-(2H5)ethyl(3-phenoxypropyl)malonat [German] [ACD/IUPAC Name]
Propanedioic acid, 2-(ethyl-d5)-2-(3-phenoxypropyl)-, diethyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 409.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.2±3.0 kJ/mol
Flash Point: 176.3±26.0 °C
Index of Refraction: 1.491
Molar Refractivity: 87.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 3.97
ACD/BCF (pH 5.5): 608.37
ACD/KOC (pH 5.5): 3423.81
ACD/LogD (pH 7.4): 3.97
ACD/BCF (pH 7.4): 608.37
ACD/KOC (pH 7.4): 3423.81
Polar Surface Area: 62 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 37.2±3.0 dyne/cm
Molar Volume: 302.0±3.0 cm3

Click to predict properties on the Chemicalize site


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