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Physical & Chemical properties

Partition coefficient

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Description of key information

Partition coefficient (LogPow): 2.09 as methyl-4-hexahydrophthalic anhydride
Partition coefficient (LogD): 1.03.as 1,2-Cyclohexanedicarboxylic acid, 4-methyl- (non-ionized)
Partition coefficient (LogD): -3.96 as 1,2-Cyclohexanedicarboxylic acid, 4-methyl- (ionized, environmental conditions)

Key value for chemical safety assessment

Log Kow (Log Pow):
-3.96
at the temperature of:
20 °C

Additional information

Partition coefficients have been investigated using methods in accordance with accepted OECD/EU test and in-silico methods.

A LogPow of 2.09 was determined for methyl-4-hexahydrophthalic anhydride (4-MHHPA)

Considering all the charge-state forms of 1,2-Cyclohexanedicarboxylic acid, 4-methyl- (4-MHHPAc) dissolved in water and in octanol, a LogD (distribution coefficient) was estimated taking account for the pH dependence of the substance in aqueous solution.

A LogD of -3.96 was estimated for 4-MHHPAc (ionized, environmental conditions)

4-MHHPA is hydrolysed practically instantaneously to 4-MHHPAc, then for the environmental and PBT assessments, the acid form was considered more significant, with logD= -3.96.