Mechanistic Insights into the Efficiency of Formaldehyde-Based Compounds and Glyoxal as H2S Scavengers Article Swipe
Caio A. Leal
,
José Walkimar de M. Carneiro
,
Rodolfo G. Fiorot
·
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.1021/acs.iecr.4c01180
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.1021/acs.iecr.4c01180
Hydrogen sulfide, H2S, poses significant challenges to the oil and gas industry due to environmental risks, safety concerns, and equipment corrosion. Nonregenerative scavengers like aldehyde-based compounds offer cost-effective solutions for the removal of H2S, crucial for reaching near-zero concentrations. However, the literature lacks comprehensive understanding of the physical–chemical aspects of H2S removal by aldehydes. Herein, we explored the reaction mechanisms involved in the H2S scavenging using aldehydes by density functional theory calculations. Thermodynamic and kinetic parameters were assessed, emphasizing the explicit role of water in lowering reaction barriers. We computed the thermochemical behavior for the formation of oligomeric compounds associated with fouling using aldehydes. Glyoxal-promoted processes presented lower energy barriers (12.5–17.5 kcal mol–1) compared to formaldehyde. Simulations also considered the hazardous nature of aldehydes by computing their formation from formaldehyde releaser compounds. These findings enhance the understanding of H2S scavenging and feature the potential of aldehyde as effective scavengers in the industry.
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Metadata
- Type
- article
- Language
- en
- Landing Page
- https://doi.org/10.1021/acs.iecr.4c01180
- OA Status
- hybrid
- Cited By
- 1
- References
- 48
- Related Works
- 10
- OpenAlex ID
- https://openalex.org/W4400949269
All OpenAlex metadata
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https://openalex.org/W4400949269Canonical identifier for this work in OpenAlex
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https://doi.org/10.1021/acs.iecr.4c01180Digital Object Identifier
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Mechanistic Insights into the Efficiency of Formaldehyde-Based Compounds and Glyoxal as H2S ScavengersWork title
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articleOpenAlex work type
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enPrimary language
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2024Year of publication
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2024-07-24Full publication date if available
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Caio A. Leal, José Walkimar de M. Carneiro, Rodolfo G. FiorotList of authors in order
- Landing page
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https://doi.org/10.1021/acs.iecr.4c01180Publisher landing page
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YesWhether a free full text is available
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hybridOpen access status per OpenAlex
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https://doi.org/10.1021/acs.iecr.4c01180Direct OA link when available
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Glyoxal, Formaldehyde, Chemistry, Organic chemistryTop concepts (fields/topics) attached by OpenAlex
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1Total citation count in OpenAlex
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2025: 1Per-year citation counts (last 5 years)
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48Number of works referenced by this work
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10Other works algorithmically related by OpenAlex
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| abstract_inverted_index.effective | 147 |
| abstract_inverted_index.equipment | 19 |
| abstract_inverted_index.formation | 95, 127 |
| abstract_inverted_index.hazardous | 120 |
| abstract_inverted_index.industry. | 151 |
| abstract_inverted_index.near-zero | 37 |
| abstract_inverted_index.potential | 143 |
| abstract_inverted_index.presented | 106 |
| abstract_inverted_index.processes | 105 |
| abstract_inverted_index.solutions | 28 |
| abstract_inverted_index.aldehydes. | 53, 103 |
| abstract_inverted_index.associated | 99 |
| abstract_inverted_index.challenges | 5 |
| abstract_inverted_index.compounds. | 131 |
| abstract_inverted_index.considered | 118 |
| abstract_inverted_index.corrosion. | 20 |
| abstract_inverted_index.functional | 69 |
| abstract_inverted_index.literature | 41 |
| abstract_inverted_index.mechanisms | 59 |
| abstract_inverted_index.oligomeric | 97 |
| abstract_inverted_index.parameters | 75 |
| abstract_inverted_index.scavengers | 22, 148 |
| abstract_inverted_index.scavenging | 64, 139 |
| abstract_inverted_index.Simulations | 116 |
| abstract_inverted_index.emphasizing | 78 |
| abstract_inverted_index.significant | 4 |
| abstract_inverted_index.(12.5–17.5 | 110 |
| abstract_inverted_index.formaldehyde | 129 |
| abstract_inverted_index.Thermodynamic | 72 |
| abstract_inverted_index.calculations. | 71 |
| abstract_inverted_index.comprehensive | 43 |
| abstract_inverted_index.environmental | 14 |
| abstract_inverted_index.formaldehyde. | 115 |
| abstract_inverted_index.understanding | 44, 136 |
| abstract_inverted_index.aldehyde-based | 24 |
| abstract_inverted_index.cost-effective | 27 |
| abstract_inverted_index.thermochemical | 91 |
| abstract_inverted_index.Nonregenerative | 21 |
| abstract_inverted_index.concentrations. | 38 |
| abstract_inverted_index.Glyoxal-promoted | 104 |
| abstract_inverted_index.physical–chemical | 47 |
| cited_by_percentile_year.max | 95 |
| cited_by_percentile_year.min | 91 |
| corresponding_author_ids | https://openalex.org/A5057125894 |
| countries_distinct_count | 1 |
| institutions_distinct_count | 3 |
| corresponding_institution_ids | https://openalex.org/I161127581 |
| sustainable_development_goals[0].id | https://metadata.un.org/sdg/2 |
| sustainable_development_goals[0].score | 0.4099999964237213 |
| sustainable_development_goals[0].display_name | Zero hunger |
| citation_normalized_percentile.value | 0.53557596 |
| citation_normalized_percentile.is_in_top_1_percent | False |
| citation_normalized_percentile.is_in_top_10_percent | False |