Registration Dossier
Registration Dossier
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EC number: 272-902-4 | CAS number: 68919-76-6
Dissociation constant
Administrative data
Link to relevant study record(s)
Description of key information
The pKa values of the mono- and di-condensation product of 400112 were calculated using the software SPARC online calculator.
Key value for chemical safety assessment
Additional information
The calculated pka values of the nitrogen (sp² hybridorbital) of the mono- and di-condensation product of 400112 exhibit a weak acidity (pKa =12.4 resp. 12.3). Also the oxygen of the mono-condensation product and the carbonyl O of the di-condensation product exhibit a weak acidity (pKa = 14.9). The nitrogen (sp³ hybridorbital) of the mono- and di-condensation product of 400112 exhibit a very strong acidity (pKa = -3.99 resp. -4.52).
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