Measurement and modeling of metoclopramide hydrochloride (anti-emetic drug) solubility in supercritical carbon dioxide

Gholamhossein Sodeifian; Chieh Ming Hsieh; Reza Derakhsheshpour; Yu Ming Chen; Fariba Razmimanesh

doi:10.1016/j.arabjc.2022.103876

Measurement and modeling of metoclopramide hydrochloride (anti-emetic drug) solubility in supercritical carbon dioxide

Gholamhossein Sodeifian
, Chieh Ming Hsieh
, Reza Derakhsheshpour
, Yu Ming Chen
, Fariba Razmimanesh

Department of Chemical and Materials Engineering

Research output: Contribution to journal › Article › peer-review

50 Scopus citations

Abstract

Knowledge of drug solubility data in supercritical carbon dioxide (SC-CO₂) is a fundamental step in producing nano and microparticles through supercritical fluid technology. In this work, for the first time, the solubility of metoclopramide hydrochloride (MCP) in SC-CO₂ was measured in pressure and temperature range of 12 to 27 MPa and 308 to 338 K, respectively. The results represented a range mole fractions of 0.15 × 10^-5 to 5.56 × 10^-5. To expand the application of the obtained data, six semi-empirical models and three models based on the Peng-Robinson equation of state (PR + VDW, PR + WS + Wilson and PR + MHV1 + COSMOSAC) with different mixing rules and various ways to describe intermolecular interactions were investigated. Furthermore, total enthalpy, sublimation enthalpy and solvation enthalpy relevant to MCP solvating in SC-CO₂ were estimated.

Original language	English
Article number	103876
Journal	Arabian Journal of Chemistry
Volume	15
Issue number	7
DOIs	https://doi.org/10.1016/j.arabjc.2022.103876
State	Published - Jul 2022

Keywords

Metoclopramide hydrochloride
Peng-Robinson equation of state
Sodeifian model
Solubility
Supercritical carbon dioxide

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10.1016/j.arabjc.2022.103876

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title = "Measurement and modeling of metoclopramide hydrochloride (anti-emetic drug) solubility in supercritical carbon dioxide",

abstract = "Knowledge of drug solubility data in supercritical carbon dioxide (SC-CO2) is a fundamental step in producing nano and microparticles through supercritical fluid technology. In this work, for the first time, the solubility of metoclopramide hydrochloride (MCP) in SC-CO2 was measured in pressure and temperature range of 12 to 27 MPa and 308 to 338 K, respectively. The results represented a range mole fractions of 0.15 × 10-5 to 5.56 × 10-5. To expand the application of the obtained data, six semi-empirical models and three models based on the Peng-Robinson equation of state (PR + VDW, PR + WS + Wilson and PR + MHV1 + COSMOSAC) with different mixing rules and various ways to describe intermolecular interactions were investigated. Furthermore, total enthalpy, sublimation enthalpy and solvation enthalpy relevant to MCP solvating in SC-CO2 were estimated.",

keywords = "Metoclopramide hydrochloride, Peng-Robinson equation of state, Sodeifian model, Solubility, Supercritical carbon dioxide",

author = "Gholamhossein Sodeifian and Hsieh, \{Chieh Ming\} and Reza Derakhsheshpour and Chen, \{Yu Ming\} and Fariba Razmimanesh",

note = "Publisher Copyright: {\textcopyright} 2022 The Authors",

year = "2022",

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doi = "10.1016/j.arabjc.2022.103876",

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volume = "15",

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T1 - Measurement and modeling of metoclopramide hydrochloride (anti-emetic drug) solubility in supercritical carbon dioxide

AU - Sodeifian, Gholamhossein

AU - Hsieh, Chieh Ming

AU - Derakhsheshpour, Reza

AU - Chen, Yu Ming

AU - Razmimanesh, Fariba

PY - 2022/7

Y1 - 2022/7

N2 - Knowledge of drug solubility data in supercritical carbon dioxide (SC-CO2) is a fundamental step in producing nano and microparticles through supercritical fluid technology. In this work, for the first time, the solubility of metoclopramide hydrochloride (MCP) in SC-CO2 was measured in pressure and temperature range of 12 to 27 MPa and 308 to 338 K, respectively. The results represented a range mole fractions of 0.15 × 10-5 to 5.56 × 10-5. To expand the application of the obtained data, six semi-empirical models and three models based on the Peng-Robinson equation of state (PR + VDW, PR + WS + Wilson and PR + MHV1 + COSMOSAC) with different mixing rules and various ways to describe intermolecular interactions were investigated. Furthermore, total enthalpy, sublimation enthalpy and solvation enthalpy relevant to MCP solvating in SC-CO2 were estimated.

AB - Knowledge of drug solubility data in supercritical carbon dioxide (SC-CO2) is a fundamental step in producing nano and microparticles through supercritical fluid technology. In this work, for the first time, the solubility of metoclopramide hydrochloride (MCP) in SC-CO2 was measured in pressure and temperature range of 12 to 27 MPa and 308 to 338 K, respectively. The results represented a range mole fractions of 0.15 × 10-5 to 5.56 × 10-5. To expand the application of the obtained data, six semi-empirical models and three models based on the Peng-Robinson equation of state (PR + VDW, PR + WS + Wilson and PR + MHV1 + COSMOSAC) with different mixing rules and various ways to describe intermolecular interactions were investigated. Furthermore, total enthalpy, sublimation enthalpy and solvation enthalpy relevant to MCP solvating in SC-CO2 were estimated.

KW - Metoclopramide hydrochloride

KW - Peng-Robinson equation of state

KW - Sodeifian model

KW - Solubility

KW - Supercritical carbon dioxide

UR - https://www.scopus.com/pages/publications/85128354287

U2 - 10.1016/j.arabjc.2022.103876

DO - 10.1016/j.arabjc.2022.103876

M3 - 期刊論文

AN - SCOPUS:85128354287

SN - 1878-5352

VL - 15

JO - Arabian Journal of Chemistry

JF - Arabian Journal of Chemistry

IS - 7

M1 - 103876

ER -

Measurement and modeling of metoclopramide hydrochloride (anti-emetic drug) solubility in supercritical carbon dioxide

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Keywords

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