Registration Dossier
Registration Dossier
Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.
The new ECHA CHEM database has been released by ECHA, and it now contains all REACH registration data. There are more details on the transition of ECHA's published data to ECHA CHEM here.
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EC number: 226-029-0 | CAS number: 5232-99-5
Partition coefficient
Administrative data
Link to relevant study record(s)
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.
Information on Registered Substances comes from registration dossiers which have been assigned a registration number. The assignment of a registration number does however not guarantee that the information in the dossier is correct or that the dossier is compliant with Regulation (EC) No 1907/2006 (the REACH Regulation). This information has not been reviewed or verified by the Agency or any other authority. The content is subject to change without prior notice.
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