| 通过模型为基础的溶液选择来调控药品化合物的形貌 |
| |
| 作者姓名： | Arunprakash T. Karunanithi Charles Acquah Luke E. K. Achenie |
| |
| 作者单位： | 1. National Risk Management Research Laboratory, U. S. Environmental Protection Agency, Cincinnati, Ohio, USA;2. Department of Chemical, Materials & Biomolecular Engineering, University of Connecticut, Storrs, Connecticut, USA;3. Department of Chemical Engineering, Virginia Polytechnic Institute and State University, Blacksburg, Virginia, USA |
| |
| 摘 要： |
|
| 收稿时间： | 2007-09-12 |
Tuning the Morphology of Pharmaceutical Compounds via Model Based Solvent Selection |
| |
| Arunprakash T. Karunanithi,Charles Acquah,Luke E. K. Achenie.Tuning the Morphology of Pharmaceutical Compounds via Model Based Solvent Selection[J].Chinese Journal of Chemical Engineering,2008,16(3):465-473. |
| |
| Authors: | Arunprakash TKarunanithi Charles Acquah Luke E K Achenie |
| |
| Affiliation: | 1. National Risk Management Research Laboratory, U. S. Environmental Protection Agency, Cincinnati, Ohio, USA;2. Department of Chemical, Materials & Biomolecular Engineering, University of Connecticut, Storrs, Connecticut, USA;3. Department of Chemical Engineering, Virginia Polytechnic Institute and State University, Blacksburg, Virginia, USA |
| |
| Abstract: | In this paper we present a strategy for tuning the crystal morphology of pharmaceutical compounds by the appropriate choice of solvent via an optimization model. A three-stage approach involving a pre-design stage, a product design stage and a post-design experimental verification stage is presented. The pre-design stage addresses the formulation of the property constraint for crystal morphology. This involves crystallization experiments and development of property models and constraints for morphology. In the design stage various property requirements for the solvent along with crystal morphology are considered and the product design problem is formulated as a mixed integer nonlinear programming model. The design stage provides an optimal solvent/list of candidate solvents. Similar to the pre-design stage, in the post design experimental verification stage, the morphology of the crystals (precipitated from the designed solvent) is verified through crystallization experiments followed by productcharacterization via scanning electron microscopy, powder X-ray diffraction imaging and Fourier transform spectra analysis. |
| |
| Keywords: | morphology solvent selection nonlinear programming crystallization product design |
| 本文献已被 万方数据 等数据库收录！ |
| 点击此处可从《中国化学工程学报》浏览原始摘要信息 |
|
点击此处可从《中国化学工程学报》下载全文 |
|
