Registration Dossier

Diss Factsheets

Physical & Chemical properties

Water solubility

Currently viewing:

Administrative data

Link to relevant study record(s)

Reference
Endpoint:
water solubility
Type of information:
(Q)SAR
Adequacy of study:
key study
Study period:
2017
Reliability:
2 (reliable with restrictions)
Rationale for reliability incl. deficiencies:
data from handbook or collection of data
Justification for type of information:
information from database
Qualifier:
according to guideline
Guideline:
other: Calculated (ACD/Labs) Software V11.02
Principles of method if other than guideline:
Calculated (ACD/Labs) Software V11.02
Key result
Water solubility:
2 g/L
Temp.:
25 °C
pH:
7
Water solubility:
600 g/L
Temp.:
25 °C
pH:
1
Water solubility:
355 g/L
Temp.:
25 °C
pH:
2
Water solubility:
71 g/L
Temp.:
25 °C
pH:
3
Water solubility:
9.7 g/L
Temp.:
25 °C
pH:
4
Water solubility:
2.9 g/L
Temp.:
25 °C
pH:
5
Water solubility:
2.2 g/L
Temp.:
25 °C
pH:
6
Water solubility:
2 g/L
Temp.:
25 °C
pH:
>= 7 - <= 10
Conclusions:
The calculated water solubility is 2.0 g/L at 25°C and pH 7.
Executive summary:

The results were calculated with (ACD/Labs) Software V11.02 and are thus considered to be reliable with restrictions.

Description of key information

The calculated water solubility is 2.0 g/L at 25°C and pH 7. The result was calculated with (ACD/Labs) Software V11.02 and is thus considered to be reliable with restrictions.

Key value for chemical safety assessment

Water solubility:
2 000 mg/L
at the temperature of:
25 °C

Additional information

Further calculated values of 5220 and 8020 mg/L are reported in databases, and are considered as supporting values. The results were calculated with generally accepted models and are thus considered to be reliable with restrictions.