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Physical & Chemical properties

Partition coefficient

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Description of key information

Log Pow is > 3.112 and Pow is 1295 at pH 7.0 - 7.1 and 24 °C (shake flask method, OECD 107), which is in good coincidence with the calculated values for the salt at pH 7.0 and 25 °C.

Calculated values:

Log D is 6.032 at pH 4.0 (25 °C, QSAR, SPARC v4.6)

Log D is 3.375 at pH 7.0 (25 °C, QSAR, SPARC v4.6)

Log D is 2.542 at pH 9.0 (25 °C, QSAR, SPARC v4.6)

Log Kow (salt) is 3.10 (QSAR, KOWWIN v1.68)

Log Kow (acid) is 6.83 (QSAR, KOWWIN v1.68)

Key value for chemical safety assessment

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