Decarboxylation of Hydroxybenzoic Acids to Phenol via Deep Eutectic Solvents.

DFT Decarboxylation Deep eutectic solvents Phenol

Journal

ChemSusChem
ISSN: 1864-564X
Titre abrégé: ChemSusChem
Pays: Germany
ID NLM: 101319536

Informations de publication

Date de publication:
07 Aug 2024
Historique:
revised: 06 08 2024
received: 12 06 2024
accepted: 07 08 2024
medline: 7 8 2024
pubmed: 7 8 2024
entrez: 7 8 2024
Statut: aheadofprint

Résumé

The development of greener and more sustainable synthesis processes for manufacturing commodity chemicals is of great importance. The majority of current phenol production methods involve harsh reaction conditions with high energy consumption, causing severe environmental pollution. In this study, we present a novel approach for the decarboxylation of hydroxybenzoic acids (HBAs) to phenol using a choline chloride-urea (ChCl-urea) deep eutectic solvent (DES). Our study reveals the remarkable dual performance of ChCl-urea both as a catalyst and solvent for the decarboxylation of HBA, resulting in a high phenol yield (94 mol%) under mild reaction conditions. The proposed reaction pathway, established through a combination of experiments and computational simulations, enhances our understanding of this process. The recyclability of the DES system during decarboxylation was also assessed. Our findings demonstrate that the integration of DES into conventional chemical processes can pave the way for sustainable manufacturing, exemplifying a novel approach for producing phenol from abundant natural resources using designer solvents.

Identifiants

pubmed: 39110600
doi: 10.1002/cssc.202401257
doi:

Types de publication

Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

e202401257

Informations de copyright

© 2024 Wiley‐VCH GmbH.

Auteurs

Da Hae Oh (DH)

Korea Institute of Science and Technology, Clean Energy Research Center, KOREA, REPUBLIC OF.

Md Al Mamunur Rashid (MAM)

Korea Institute of Science and Technology, Clean Energy Research Center, KOREA, REPUBLIC OF.

Chun-Jae Yoo (CJ)

Korea Institute of Science and Technology, Clean Energy Research Center, KOREA, REPUBLIC OF.

Jeong-Myeong Ha (JM)

Korea Institute of Science and Technology, Clean Energy Research Center, KOREA, REPUBLIC OF.

Bonwook Koo (B)

Kyungpook National University, Wood & Paper Science, KOREA, REPUBLIC OF.

Jungkyu Choi (J)

Korea University, Chemical Engineering, KOREA, REPUBLIC OF.

Keunhong Jeong (K)

Korea Military Academy, Chemistry, KOREA, REPUBLIC OF.

Kwang Ho Kim (KH)

University of British Columbia, Wood Science, 2424 Main Mall, V6T1Z4, Vancouver, CANADA.

Classifications MeSH