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Physical & Chemical properties

Water solubility

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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..