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Dissociation constant

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Reference
Endpoint:
dissociation constant
Type of information:
(Q)SAR
Adequacy of study:
key study
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
Dissociating properties:
yes
pKa:
4.58
Temp.:
25 °C

The calculated value for the pKa value is reported to 4.58+/-0.46.

Conclusions:
The calculated value for the pKa is reported to 4.58+/-0.46 at 25°C.
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 value for the pKa is reported to 4.58+/-0.46 at 25°C. The results were calculated with (ACD/Labs) Software V11.02 and are thus considered to be reliable with restrictions.

Key value for chemical safety assessment

pKa at 20°C:
4.58

Additional information