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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

Water solubility

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Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Calculation of water solubility is performed with EPI SUITE, WSKOW v.1.42, accepted estimation method from ECHA Guidelines.
Principles of method if other than guideline:
WSKOW v.1.42; part of: Estimation Programs Interface (EPI) Suite TM
Key result
Water solubility:
0 mg/L
Temp.:
25 °C
pH:
7
Conclusions:
Calculation of water solubility with EPI SUITE, WSKOW v.1.42: 0.000000004344 mg/L
Endpoint:
water solubility
Type of information:
read-across from supporting substance (structural analogue or surrogate)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Since the test item is a reaction mass of hexadecanoic anhydride and hexadecanoic acid, hexadecanoic anhydride was used for the read-across.
Calculation of water solubility is performed with EPI SUITE, WSKOW v.1.42, accepted estimation method from ECHA Guidelines.
Reason / purpose for cross-reference:
read-across source
Principles of method if other than guideline:
WSKOW v.1.42; part of: Estimation Programs Interface (EPI) Suite TM
Key result
Water solubility:
0 mg/L
Temp.:
25 °C
pH:
7
Conclusions:
Calculation of water solubility with EPI SUITE, WSKOW v.1.42: 0.000000004344 mg/L
Endpoint:
water solubility
Type of information:
calculation (if not (Q)SAR)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Calculation of water solubility is performed with EPI SUITE, WSKOW v.1.42, accepted estimation method from ECHA Guidelines.
Principles of method if other than guideline:
WSKOW v.1.42; part of: Estimation Programs Interface (EPI) Suite TM
Key result
Water solubility:
0.04 mg/L
Temp.:
25 °C
pH:
7
Conclusions:
Calculation of water solubility with EPI SUITE, WSKOW v.1.42: 0.04 mg/L
Endpoint:
water solubility
Type of information:
read-across from supporting substance (structural analogue or surrogate)
Adequacy of study:
key study
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
accepted calculation method
Justification for type of information:
Since the test item is a reaction mass of hexadecanoic anhydride and hexadecanoic acid, hexadecanoic acid was used for the read-across.
Calculation of water solubility is performed with EPI SUITE, WSKOW v.1.42, accepted estimation method from ECHA Guidelines.
Reason / purpose for cross-reference:
read-across source
Principles of method if other than guideline:
WSKOW v.1.42; part of: Estimation Programs Interface (EPI) Suite TM
Key result
Water solubility:
0.04 mg/L
Temp.:
25 °C
pH:
7
Conclusions:
Calculation of water solubility with EPI SUITE, WSKOW v.1.42: 0.04 mg/L

Description of key information

Since the test item is a reaction mass of hexadecanoic anhydride and hexadecanoic acid, hexadecanoic anhydride and hexadecanoic acid were used for the read-across.

Calculation for water solubility with software tool WSKOW v.1.42

for hexadecanoic anhydride : 0.000000004344 mg/L

Calculation for water solubility with software tool WSKOW v.1.42

for hexadecanoic acid: 0.04 mg/L

The water solubility of the test item should be included between 0.000000004344 mg/L and 0.04 mg/L (at 25 °C).

Key value for chemical safety assessment

Additional information