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Please be aware that this old REACH registration data factsheet is no longer maintained; it remains frozen as of 19th May 2023.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.

Diss Factsheets

Physical & Chemical properties

Boiling point

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boiling point
Type of information:
Adequacy of study:
supporting study
Study period:
2 (reliable with restrictions)
no guideline followed
Principles of method if other than guideline:
The estimation methodology for boiling point is adapted from the Adapted Stein & Brown method
GLP compliance:
Type of method:
other: calcucation by QSAR
Specific details on test material used for the study:
The following SMILES code was entered: COc1ccc(cc1)Oc2c(cc(cc2I)CC(C(=O)O)N)I
Boiling pt.:
>= 610.32 °C
The boiling temperature was calculated to 610,32 °C.
Executive summary:

The boiling temperature was calculated to 463 °C using the MPBPVP v1.43 tool within EpiSuite v4.1 programme.

Description of key information

The test item is suspected to docompose between 180 and 205 °C.

Key value for chemical safety assessment

Additional information