Estimation of Kinetics for Batch Cooling Crystallization by Focused-Beam Reflectance Measurements

Joi Unno, Hiroki Kawase, Reiya Kaneshige, Izumi Hirasawa

Research output: Contribution to journalArticle

Abstract

Numerical simulation of the seeded batch cooling crystallization process of active pharmaceutical ingredients was performed. Crystal size distribution was observed by focused-beam reflectance measurements and concentration by simultaneous Fourier transform infrared spectroscopy. First, kinetic parameters were estimated. Nucleation rate coefficient and order were estimated from the linear regression equation between cooling rate and metastable zone width. The remaining parameters were estimated from the evaluation function. Then, the numerical simulation was performed by utilizing the method of moments. Finally, observed data were compared with simulated data. The simulated values of mean mass size corresponded reasonably with the observed ones.

Original languageEnglish
JournalChemical Engineering and Technology
DOIs
Publication statusPublished - 2019 Jan 1

Fingerprint

Reflectometers
Crystallization
Cooling
Kinetics
Function evaluation
Computer simulation
Method of moments
Kinetic parameters
Linear regression
Drug products
Fourier transform infrared spectroscopy
Nucleation
Crystals
Pharmaceutical Preparations

Keywords

  • Active pharmaceutical ingredients
  • Crystal size distribution
  • Crystallization
  • Focused-beam reflectance measurements
  • Simulation

ASJC Scopus subject areas

  • Chemistry(all)
  • Chemical Engineering(all)
  • Industrial and Manufacturing Engineering

Cite this

Estimation of Kinetics for Batch Cooling Crystallization by Focused-Beam Reflectance Measurements. / Unno, Joi; Kawase, Hiroki; Kaneshige, Reiya; Hirasawa, Izumi.

In: Chemical Engineering and Technology, 01.01.2019.

Research output: Contribution to journalArticle

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