Kinetic model to estimate the amount of nitrosamines

I would like to know if you use a kinetic model to estimate the amount of nitrosamines formed in the finished product.
Do you use any validated program?
Thanks.

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@celso.nicoleti I suggest to look into the presentation that Dr. Moser deliver at the recent CRCG workshopā€¦

His presentation and recording:

Please share more with our community your particular are of interest
Thanks,

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@celso.nicoleti , destaco dois artigos relevantes sobre o tema:

Formation of Dialkyl-N-nitrosamines in Aqueous Solution: An Experimental Validation of a Conservative Predictive Model and a Comparison of the Rates of Dialkyl and Trialkylamine Nitrosation

Potential for the Formation of N-Nitrosamines during the Manufacture of Active Pharmaceutical Ingredients: An Assessment of the Risk Posed by Trace Nitrite in Water

Em ambos os artigos, Ć© possĆ­vel observar a realizaĆ§Ć£o de simulaƧƵes cinĆ©ticas utilizando a versĆ£o 8.3 do software Berkeley Madonna. Essas simulaƧƵes foram conduzidas com o propĆ³sito de resolver numericamente as equaƧƵes diferenciais ao longo do perĆ­odo de tempo desejado.

Espero que estas informaƧƵes tenham sido Ćŗteis para a sua pesquisa. Fique Ć  vontade para compartilhar suas observaƧƵes

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Naiffer, thank you for the feedback.

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Muito obrigado Lucas!

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@celso.nicoleti, para soluƧƵes estamos utilizando um programa em excel/VBA desenvolvido internamente para aplicar o modelo cinƩtico apresentado em https://pubs.acs.org/doi/10.1021/acs.oprd.0c00224

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