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Partition coefficient

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Description of key information

Calculated log Pow= 4.01 at 25°C

Key value for chemical safety assessment

Additional information

As the substance does not dissolve in water therefore it is not possible to determine the logPow experimentally.The logPow has to be calculated instead. The represented value was calculated based on fragment method using KOWWIN (v1.68) module of software EPI Suite and the molecular weight is within range of training and validation set.

In addition, the logPow value has been calculated with 2 other scientific acceptable software programs and the results are given as follows:

1) logPow= 3.97 using ALOGPS 2.1 program cited in ©VCCLAB2007

2) logPow= 3.99 using ACD/Labs V11.02 program cited in SciFinder Database

The estimated values of 3 different programs are in reasonably close agreement.