Registration Dossier
Registration Dossier
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EC number: 246-771-9 | CAS number: 25265-77-4
Water solubility
Administrative data
Link to relevant study record(s)
Description of key information
Estimates for Water Solubility, using four different QSAR models: WSKOW, WATERNT, SPARC, and ACDLabs.
Key value for chemical safety assessment
Additional information
The water solubility in mg/L, was estimated using 4 QSAR modeling programs. Data tabulated below..
WSKOW yeilds a value of 502.2 mg/L 25 C, using a Log Kow of 3.2 and a melting Point of -70.25 C. Not entering a Melting Point yielded a value of 215.5.
WATERNT yields a value of 1360 mg/L 25 C
SPARC yields a value of 3790 mg/L 25 C
ACD Labs yields a value of 1610 mg/L 25 C
From this data, the water solubility of this material is in the moderately soluble to soluble range, with the majority of values being in the soluble range of 1000 -10,000 mg/L..
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