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Physical & Chemical properties

Water solubility

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Description of key information

The QSAR estimated water solubility of 2,3-Epoxypropyl Neodecanoate was 68 - 156 mg/L at 20 - 25 degrees C.  The water solubility of the test substance was also determined experimentally by an O.E.C.D. test guideline no. 105 study using the Flask method.    

Key value for chemical safety assessment

Water solubility:
70 mg/L
at the temperature of:
20 °C

Additional information

The water solubility of 2,3 -Epoxypropyl Neodecanoate was estimated by two different QSAR models. The O.E.C.D. Toolbox Water Sol. structural fragment QSAR model estimated a water solubilty for the test substance of 68 mg/L at 20 Degrees C. The calculated value for the diol from of 2,3 -Epoxypropyl Neodecanoate using MPBPWIN version 1.40, a subroutine of the computer program EPIWIN version 3.04, was approximately 156 mg/L at 25 Degrees C. The results of the O.E.C.D. test guideline no.105 study demonstrated that the mean water solubility of the test substance based upon three independent determinations was 70 mg/L +/- 2.9 mg/L at 20.0 ± 0.5 °C. Therefore, the test substance is considered to be slightly soluble in water.