Influence of solvent choice on the optimisation of a reaction-separation operation:: application to a Beckmann rearrangement reaction

被引:11
作者
Elgue, S
Prat, L
Cognet, P
Cabassud, M
Le Lann, JM
Cézerac, J
机构
[1] UPS, CNRS, INPT, ENSIACET,Lab Genie Chim,UMR 5503, F-31106 Toulouse 1, France
[2] Sanofi Synthelabo, F-04201 Sisteron, France
关键词
optimisation; solvent choice; batch process; reaction-separation operation; dynamic simulation;
D O I
10.1016/S1383-5866(03)00200-4
中图分类号
TQ [化学工业];
学科分类号
0817 ;
摘要
In pharmaceutical syntheses, the solvent choice generally represents a complex design step. Traditionally, this choice is operated according to criteria connected with the reaction step and without any consideration on the following separation steps. The purpose of this study is to highlight the benefits of a global approach of optimisation for the solvent determination. In this way, an optimisation framework dedicated to global synthesis is applied to a simple reaction-separation operation integrating a Beckmann rearrangement reaction, leading to interesting solvent choices. (C) 2003 Elsevier B.V. All rights reserved.
引用
收藏
页码:273 / 281
页数:9
相关论文
共 11 条
[1]   Studies of the Beckmann change Part I The spontaneous rearrangement of oxime picryl ethers [J].
Chapman, AW ;
Howis, CC .
JOURNAL OF THE CHEMICAL SOCIETY, 1933, :806-811
[2]  
CISMONDI M, 2000, P ESCAPE 11 KOLD 27, P375
[3]  
ELGUE S, 2001, P ESCAPE 11 KOLD 27, P1127
[4]   MOLECULAR DESIGN OF SOLVENTS FOR LIQUID EXTRACTION BASED ON UNIFAC [J].
GANI, R ;
BRIGNOLE, EA .
FLUID PHASE EQUILIBRIA, 1983, 13 (OCT) :331-340
[5]   Design of environmentally benign processes: integration of solvent design and separation process synthesis [J].
Hostrup, M ;
Harper, PM ;
Gani, R .
COMPUTERS & CHEMICAL ENGINEERING, 1999, 23 (10) :1395-1414
[6]   Rapid plant-wide screening of solvents for batch processes [J].
Modi, A ;
Aumond, JP ;
Mavrovouniotis, M ;
Stephanopoulos, G .
COMPUTERS & CHEMICAL ENGINEERING, 1996, 20 (Suppl pt A) :S375-S380
[7]  
ODELE O, 1993, FLUID PHASE EQUILIBR, V82, P47, DOI 10.1016/0378-3812(93)87127-M
[8]   Optimal solvent design for environmental impact minimization [J].
Pistikopoulos, EN ;
Stefanis, SK .
COMPUTERS & CHEMICAL ENGINEERING, 1998, 22 (06) :717-733
[9]   COMPUTER-AIDED MOLECULAR DESIGN OF SOLVENTS FOR SEPARATION PROCESSES [J].
PRETEL, EJ ;
LOPEZ, PA ;
BOTTINI, SB ;
BRIGNOLE, EA .
AICHE JOURNAL, 1994, 40 (08) :1349-1360
[10]  
SARGOUSSE A, P MOSIM 99 ANN FRANC