Design of alternate solvent for recovery of residual palm oil: simultaneous optimization of process performance with environmental, health and safety aspects

In this work, a computer-aided molecular design (CAMD)-based approach has been developed to design alternative solvents for extracting palm oil from palm pressed fibre (PPF). PPF is a by-product from palm oil milling process produced during the extraction of crude palm oil from fresh fruit bunches. It is noted that the oil that found in PPF consists of high concentration of carotenoids; therefore, palm oil industries are trying to recover the residual oil in PPF. Hexane is conventionally used as a solvent to extract PPF. However, hexane has high boiling point which leads to significant degradation of carotene during solvent recovery. Besides, hexane is considered as a toxic chemical; thus, the extracted oil cannot be used in food applications. In order to overcome the limitations of hexane, this work presents a systematic approach to generate alternative solvents with desirable attributes for PPF oil extraction via CAMD with the integration of safety and health aspects. In this work, diffusivity is defined as a key parameter to evaluate the solvent functionality because the solvent must diffuse through the fibrous matrix to solubilize trapped oil. The safety and health aspects were assessed by implementing disjunctive programming to discretize the properties for allocation of subindex scores. The developed algorithm can trade-off the process and environmental, health and safety (EHS) performances and identify alternative solvents which improve EHS performance compare with hexane.

[1]  Rafiqul Gani,et al.  A computer-aided molecular design framework for crystallization solvent design , 2006 .

[2]  Rafiqul Gani,et al.  Computer-aided molecular design with combined molecular modeling and group contribution , 1999 .

[3]  H. Wakeham,et al.  Diffusion Phenomena in Solvent Extraction of Peanut Oil , 1948 .

[4]  P. J. Wan,et al.  Alternative hydrocarbon solvents for cottonseed extraction , 1995 .

[5]  D. Mcclements,et al.  Factors Influencing the Chemical Stability of Carotenoids in Foods , 2010, Critical reviews in food science and nutrition.

[6]  Gianfranco Panfili,et al.  Degradation of carotenoids in orange juice during microwave heating , 2010 .

[7]  A. Junaidi Palm pressed fibre oil: A new opportunity for premium hardstock? , 2011 .

[8]  Chin Ping Tan,et al.  Optimization of ultrasound extraction condition of phospholipids from palm-pressed fiber. , 2009 .

[9]  Emmanuel Stefanis,et al.  Prediction of Hansen Solubility Parameters with a New Group-Contribution Method , 2008 .

[10]  Mahmoud M. El-Halwagi,et al.  A fuzzy mixed‐integer linear programming model for optimal design of polygeneration systems with cyclic loads , 2016 .

[11]  Arunprakash T. Karunanithi,et al.  Optimal design of ionic liquids for thermal energy storage , 2016, Comput. Chem. Eng..

[12]  F. Chemat,et al.  Alternative Bio-Based Solvents for Extraction of Fat and Oils: Solubility Prediction, Global Yield, Extraction Kinetics, Chemical Composition and Cost of Manufacturing , 2015, International journal of molecular sciences.

[13]  Denny K. S. Ng,et al.  A molecular design methodology by the simultaneous optimisation of performance, safety and health aspects , 2017 .

[14]  Jorge A. Marrero,et al.  Group-contribution based estimation of pure component properties , 2001 .

[15]  Y. Tulek,et al.  Degradation kinetics of lycopene, β-carotene and ascorbic acid in tomatoes during hot air drying , 2013 .

[16]  C. Wilke,et al.  Correlation of diffusion coefficients in dilute solutions , 1955 .

[17]  Y. Koyama,et al.  Triplet-sensitized and thermal isomerization of all-trans, 7-cis, 9-cis, 13-cis, and 15-cis isomers of. beta. -carotene: Configurational dependence of the quantum yield of isomerization via the T sub 1 state , 1991 .

[18]  Jose B. Cruz,et al.  Bi-level fuzzy optimization approach for water exchange in eco-industrial parks , 2010 .

[19]  Nikolaos V. Sahinidis,et al.  Optimization‐based framework for computer‐aided molecular design , 2013 .

[20]  Fadwa T. Eljack,et al.  A systematic approach to design task-specific ionic liquids and their optimal operating conditions , 2016 .

[21]  Denny K. S. Ng,et al.  Fuzzy mixed-integer linear programming model for optimizing a multi-functional bioenergy system with biochar production for negative carbon emissions , 2014, Clean Technologies and Environmental Policy.

[22]  T M Martin,et al.  Prediction of the acute toxicity (96-h LC50) of organic compounds to the fathead minnow (Pimephales promelas) using a group contribution method. , 2001, Chemical research in toxicology.

[23]  Yuen May Choo,et al.  Selective extraction of palm carotene and vitamin E from fresh palm-pressed mesocarp fiber (Elaeis guineensis) using supercritical CO2 , 2008 .

[24]  Mario R. Eden,et al.  Simultaneous solution of process and molecular design problems using an algebraic approach , 2010, Comput. Chem. Eng..

[25]  Z. Husain,et al.  Briquetting of palm fibre and shell from the processing of palm nuts to palm oil , 2002 .

[26]  J A McCammon,et al.  Computer-aided molecular design. , 1987, Science.

[27]  Denny K. S. Ng,et al.  Computer Aided Molecular Design for alternative sustainable solvent to extract oil from palm pressed fibre , 2017 .

[28]  H. Zimmermann Fuzzy programming and linear programming with several objective functions , 1978 .

[29]  Farid Chemat,et al.  Is it possible to substitute hexane with green solvents for extraction of carotenoids? A theoretical versus experimental solubility study , 2016 .

[30]  Alexandre F. Santos,et al.  Extraction of palm oil using propane, ethanol and its mixtures as compressed solvent , 2013 .

[31]  Sabu Thomas,et al.  Oil palm fibers: Morphology, chemical composition, surface modification, and mechanical properties , 1997 .

[32]  Y. Choo,et al.  Recovered oil from palm-pressed fiber: A good source of natural carotenoids, vitamin E, and sterols , 1996 .

[33]  R. Guirardello,et al.  Determination of the Hansen Solubility Parameters of Vegetable Oils, Biodiesel, Diesel, and Biodiesel–Diesel Blends , 2015 .

[34]  Gürkan Sin,et al.  Estimation of Environment-Related Properties of Chemicals for Design of Sustainable Processes: Development of Group-Contribution+ (GC+) Property Models and Uncertainty Analysis , 2012, J. Chem. Inf. Model..

[35]  Rafiqul Gani,et al.  Combined Group-Contribution and Atom Connectivity Index-Based Methods for Estimation of Surface Tension and Viscosity , 2008 .

[36]  Mahmoud M. El-Halwagi,et al.  Fuzzy mixed integer non-linear programming model for the design of an algae-based eco-industrial park with prospective selection of support tenants under product price variability , 2016 .

[37]  Rafiqul Gani,et al.  Blanket Wash Solvent Blend Design Using Interval Analysis , 2003 .

[38]  Denny K. S. Ng,et al.  Hybrid Optimisation Model for the Synthesis of Centralised Utility System in Eco-Industrial Park , 2017 .

[39]  Denny K. S. Ng,et al.  Fuzzy Optimization Approach for the Synthesis of a Sustainable Integrated Biorefinery , 2011 .

[40]  Sandro Macchietto,et al.  Computer aided molecular design: a novel method for optimal solvent selection , 1993 .

[41]  Qingsheng Wang,et al.  Correlations for estimating flammability limits of pure fuels and fuel-inert mixtures , 2013 .

[42]  Kaisa Miettinen,et al.  Nonlinear multiobjective optimization , 1998, International series in operations research and management science.

[43]  Mahmoud M. El-Halwagi,et al.  Simultaneous process and molecular design—A property based approach , 2007 .

[44]  P. Bohuon,et al.  Kinetic study of β‐carotene and lutein degradation in oils during heat treatment , 2010 .

[45]  S. Ferreira-Dias,et al.  Comparison between ethanol and hexane for oil extraction from Quercus suber L. fruits , 2003 .

[46]  Richard Bellman,et al.  Decision-making in fuzzy environment , 2012 .

[47]  Allan F. M. Barton,et al.  CRC Handbook of solubility parameters and other cohesion parameters , 1983 .

[48]  Rafiqul Gani,et al.  Computer-Aided Methods and Tools for Chemical Product Design , 2004 .

[49]  Raymond R. Tan,et al.  A fuzzy multiple-objective approach to the optimization of bioenergy system footprints , 2009 .

[50]  Didier Dubois,et al.  Computing improved optimal solutions to max-min flexible constraint satisfaction problems , 1999, Eur. J. Oper. Res..

[51]  D. Ng,et al.  Systematic Approach for Synthesis of Integrated Palm Oil Processing Complex. Part 1: Single Owner , 2013 .