ChemSpider 2D Image | 3-(2-{3-[(2-Methyl-2-propanyl)oxy]-3-oxopropoxy}ethoxy)propanoic acid | C12H22O6

3-(2-{3-[(2-Methyl-2-propanyl)oxy]-3-oxopropoxy}ethoxy)propanoic acid

  • Molecular FormulaC12H22O6
  • Average mass262.299 Da
  • Monoisotopic mass262.141632 Da
  • ChemSpider ID72384203

More details:

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

2086688-99-3 [RN]
3-(2-{3-[(2-Methyl-2-propanyl)oxy]-3-oxopropoxy}ethoxy)propanoic acid [ACD/IUPAC Name]
3-(2-{3-[(2-Methyl-2-propanyl)oxy]-3-oxopropoxy}ethoxy)propansäure [German] [ACD/IUPAC Name]
Acide 3-(2-{3-[(2-méthyl-2-propanyl)oxy]-3-oxopropoxy}éthoxy)propanoïque [French] [ACD/IUPAC Name]
Propanoic acid, 3,3'-[1,2-ethanediylbis(oxy)]bis-, 1,1-dimethylethyl ester [ACD/Index Name]
Propanoic acid, 3-[2-(2-carboxyethoxy)ethoxy]-, 1-(1,1-dimethylethyl) ester
3-[2-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]ethoxy]propanoic acid
3-{2-[3-(tert-butoxy)-3-oxopropoxy]ethoxy}propanoic acid
Acid-PEG2-C2-Boc
Acid-PEG2-t-butyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.1±0.1 g/cm3
Boiling Point: 384.3±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 69.5±6.0 kJ/mol
Flash Point: 138.2±17.2 °C
Index of Refraction: 1.455
Molar Refractivity: 64.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 0.86
ACD/LogD (pH 5.5): -0.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.44
ACD/LogD (pH 7.4): -2.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 82 Å2
Polarizability: 25.5±0.5 10-24cm3
Surface Tension: 38.2±3.0 dyne/cm
Molar Volume: 237.5±3.0 cm3

Click to predict properties on the Chemicalize site


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