Nitrogenous Disinfection Byproduct Yields from Breakpoint Chlorination Experiments

13.6 KB of experimental data on nitrogenous disinfection byproduct (N-DBP) formation. The dataset, authored by Zachary T. Kralles and last updated in April 2026, contains molar yields of dichloroacetonitrile (0.1–7.4% from phenols, 0.4–2.6% from anilines) and identifies higher-carbon N-DBPs formed under breakpoint chlorination conditions.

Use Cases

• Modeling N-DBP formation pathways based on identified intermediates like chloro(hydroxy)anilines
• Comparing byproduct yields from breakpoint chlorination versus free chlorination based on the experimental conditions described
• Analyzing the relationship between precursor structure (phenols vs. anilines) and dichloroacetonitrile yield
• Investigating the role of ammonia-nitrogen incorporation into aromatic moieties as described in the findings

Strengths

• Includes specific molar yield ranges for dichloroacetonitrile (0.1–7.4% from phenols, 0.4–2.6% from anilines)
• Data is structured in an XLSX file (13.6 KB) for direct analysis
• Findings are based on model compounds with systematically varied structures as described

Limitations

• Row count is unknown, which may limit suitability assessment
• Column-level documentation is absent; field semantics must be inferred after download
• The dataset's 13.6 KB size suggests a limited scope of experimental results

Provenance

Source

figshare, author Zachary T. Kralles

Collection Method

Experimental study using model compounds, liquid chromatography–high-resolution mass spectrometry, kinetic modeling

Time Range

Experimental timeframe not specified in metadata

Freshness

Last updated 2026-04-15 02:13:30

Geography

Geographic scope not specified in metadata