N-(ethylmercurio)toluene-4-sulphonanilide (CED0172844)

Record Information
Version1.0
Creation Date2026-04-05 18:07:01 UTC
Update Date2026-08-18 23:08:33 UTC
SynCED IDCED0172844
Secondary Accession Numbers
  • CHEM105675
Identification
Common NameN-(ethylmercurio)toluene-4-sulphonanilide
ClassSmall Molecule
Description
N-(ethylmercurio)toluene-4-sulphonanilide is an organic compound with the formula C15H17HgNO2S and an average molecular weight of 476.00 g/mol. N-(ethylmercurio)toluene-4-sulphonanilide belongs to the sulfanilides, a subclass of benzene and substituted derivatives within the organic compounds. This compound is associated with six recorded sources of release or occurrence. Within the category of electrical and electronic equipment, it is found in radio transmission systems, antennas, and television systems. It is also present in household cleaning and consumer products, specifically within soap detergents and perfumes used in detergents and soaps. Additionally, it is utilized in food, food processing, and cookware for the purpose of food preservation.
Contaminant TypeNot Available
Chemical Structure
SynonymsNot Available
Chemical FormulaC15H17HgNO2S
Average Molecular Mass476.000 g/mol
Monoisotopic Mass477.069 g/mol
CAS Registry Number517-16-8
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1/C13H12NO2S.C2H5.Hg/c1-11-7-9-13(10-8-11)17(15,16)14-12-5-3-2-4-6-12;1-2;/h2-10H,1H3;1H2,2H3;/q-1;;+1/rC15H17HgNO2S/c1-3-16-17(14-7-5-4-6-8-14)20(18,19)15-11-9-13(2)10-12-15/h4-12H,3H2,1-2H3
InChI KeyXAGAASDWSFGQEC-UHFFFAOYSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity ValuesNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementNot Available
CEDs000506Antennas?Antennas, commonly used in communication technologies, can be a source of synthetic chemical contamination through the materials and coatings used in their construction.Electrical & Electronic EquipmentNot Available
CEDs000530Radio Transmission Systems?Radio transmission systems utilize a variety of synthetic chemicals in their manufacturing and maintenance processes.Electrical & Electronic EquipmentNot Available
CEDs000537Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.Electrical & Electronic EquipmentNot Available
CEDs000545Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.Food, food processing & cookwareNot Available
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsNot Available
CEDs000563Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.Household cleaning & consumer productsNot Available
CEDs000583Anchoring Equipment?Anchoring equipment, commonly used in marine applications, can be a source of synthetic chemical contamination due to the materials and coatings utilized in their manufacturing.Marine, shipping & aquacultureNot Available
CEDs000596Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.Agriculture & land managementNot Available
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementNot Available
CEDs000601Lawn Mowers?Lawn mowers, particularly those powered by gasoline, can be a source of synthetic chemical contamination due to the combustion of fossil fuels and the use of engine oils.Agriculture & land managementNot Available
CEDs000602Molluscicides?Molluscicides are synthetic chemicals specifically designed to control and eliminate mollusks, such as snails and slugs, which can be detrimental to crops and agricultural productivity.Agriculture & land managementNot Available
CEDs000603Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.Agriculture & land managementNot Available
CEDs000605Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.Agriculture & land managementNot Available
CEDs000606Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.Agriculture & land managementNot Available
CEDs000678Nitrogenous Fertilisers?Nitrogenous fertilizers are synthetic chemical compounds primarily used to enhance plant growth by supplying essential nitrogen, a crucial nutrient for photosynthesis and protein synthesis.Agriculture & land managementNot Available
CEDs000679Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.Agriculture & land managementNot Available
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsNot Available
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsNot Available
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.Paper, pulp & fiber productsNot Available
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)
Prediction Confidence Score
0.359
Applicability Domain
0.39
Statistical Significance
0.0113
Supporting Reference Compounds
372
E-value
87.8918
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)
Prediction Confidence Score
0.359
Applicability Domain
0.39
Statistical Significance
0.0108
Supporting Reference Compounds
332
E-value
83.8436
Click to view 3D structureOrganic anion transporter 3O88909Mus musculusPredicted (SEA)
Prediction Confidence Score
0.356
Applicability Domain
0.356
Statistical Significance
2.30e-04
Supporting Reference Compounds
1
E-value
1.79053
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)
Prediction Confidence Score
0.349
Applicability Domain
0.39
Statistical Significance
0.0174
Supporting Reference Compounds
472
E-value
135.224
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)
Prediction Confidence Score
0.326
Applicability Domain
0.39
Statistical Significance
0.0223
Supporting Reference Compounds
407
E-value
173.837
Click to view 3D structureC5a anaphylatoxin chemotactic receptor 1P97520Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.321
Applicability Domain
0.321
Statistical Significance
1.60e-04
Supporting Reference Compounds
1
E-value
1.24559
Click to view 3D structureBeta-ketoacyl-ACP-synthase IIIO77078Plasmodium falciparumPredicted (SEA)
Prediction Confidence Score
0.306
Applicability Domain
0.306
Statistical Significance
3.40e-04
Supporting Reference Compounds
1
E-value
2.64687
Carbonic anhydrase 7 structureClick to view 3D structureCarbonic anhydrase 7P43166HumansPredicted (SEA)
Prediction Confidence Score
0.3
Applicability Domain
0.351
Statistical Significance
0.0206
Supporting Reference Compounds
242
E-value
160.603
72 kDa type IV collagenase structureClick to view 3D structure72 kDa type IV collagenaseP08253HumansPredicted (SEA)
Prediction Confidence Score
0.295
Applicability Domain
0.305
Statistical Significance
0.0489
Supporting Reference Compounds
400
E-value
380.916
Matrix metalloproteinase-9 structureClick to view 3D structureMatrix metalloproteinase-9P14780HumansPredicted (SEA)
Prediction Confidence Score
0.295
Applicability Domain
0.305
Statistical Significance
0.0449
Supporting Reference Compounds
292
E-value
349.309
Neutrophil collagenase structureClick to view 3D structureNeutrophil collagenaseP22894HumansPredicted (SEA)
Prediction Confidence Score
0.295
Applicability Domain
0.305
Statistical Significance
0.0323
Supporting Reference Compounds
176
E-value
251.531
Cytochrome P450 2C9 structureClick to view 3D structureCytochrome P450 2C9P11712HumansPredicted (SEA)
Prediction Confidence Score
0.295
Applicability Domain
0.328
Statistical Significance
0.1519
Supporting Reference Compounds
1245
E-value
1182.37
Stromelysin-1 structureClick to view 3D structureStromelysin-1P08254HumansPredicted (SEA)
Prediction Confidence Score
0.294
Applicability Domain
0.305
Statistical Significance
0.0321
Supporting Reference Compounds
200
E-value
250.13
Protein RecA structureClick to view 3D structureProtein RecAP9WHJ3Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.294
Applicability Domain
0.315
Statistical Significance
0.0145
Supporting Reference Compounds
296
E-value
112.57
Interstitial collagenase structureClick to view 3D structureInterstitial collagenaseP03956HumansPredicted (SEA)
Prediction Confidence Score
0.293
Applicability Domain
0.305
Statistical Significance
0.0351
Supporting Reference Compounds
258
E-value
272.939
Collagenase 3 structureClick to view 3D structureCollagenase 3P45452HumansPredicted (SEA)
Prediction Confidence Score
0.286
Applicability Domain
0.305
Statistical Significance
0.0417
Supporting Reference Compounds
269
E-value
324.631
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)
Prediction Confidence Score
0.286
Applicability Domain
0.328
Statistical Significance
0.2424
Supporting Reference Compounds
1538
E-value
1887.07
Cytochrome P450 2C19 structureClick to view 3D structureCytochrome P450 2C19P33261HumansPredicted (SEA)
Prediction Confidence Score
0.281
Applicability Domain
0.328
Statistical Significance
0.1272
Supporting Reference Compounds
825
E-value
990.32
Click to view 3D structureNeuropeptide Y receptor type 5O70342Mus musculusPredicted (SEA)
Prediction Confidence Score
0.281
Applicability Domain
0.291 Low confidence
Statistical Significance
0.0015
Supporting Reference Compounds
13
E-value
11.366
Macrophage metalloelastase structureClick to view 3D structureMacrophage metalloelastaseP39900HumansPredicted (SEA)
Prediction Confidence Score
0.279
Applicability Domain
0.305
Statistical Significance
0.0373
Supporting Reference Compounds
136
E-value
290.378
Matrix metalloproteinase-14 structureClick to view 3D structureMatrix metalloproteinase-14P50281HumansPredicted (SEA)
Prediction Confidence Score
0.278
Applicability Domain
0.288 Low confidence
Statistical Significance
0.044
Supporting Reference Compounds
198
E-value
342.459
Toll-like receptor 9 structureClick to view 3D structureToll-like receptor 9Q9NR96HumansPredicted (SEA)
Prediction Confidence Score
0.278
Applicability Domain
0.342
Statistical Significance
0.0081
Supporting Reference Compounds
111
E-value
63.2914
Click to view 3D structureMacrophage metalloelastaseP34960Mus musculusPredicted (SEA)
Prediction Confidence Score
0.276
Applicability Domain
0.305
Statistical Significance
0.0052
Supporting Reference Compounds
8
E-value
40.4816
Beta-carbonic anhydrase 1 structureClick to view 3D structureBeta-carbonic anhydrase 1P9WPJ7Mycobacterium tuberculosisPredicted (SEA)
Prediction Confidence Score
0.275
Applicability Domain
0.357
Statistical Significance
0.0111
Supporting Reference Compounds
55
E-value
86.1012
Mucolipin-3 structureClick to view 3D structureMucolipin-3Q8TDD5HumansPredicted (SEA)
Prediction Confidence Score
0.274
Applicability Domain
0.34
Statistical Significance
0.0011
Supporting Reference Compounds
26
E-value
8.48557
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available