Hydrocyanite (CED0042672)

Record Information
Version1.0
Creation Date2016-05-26 01:03:58 UTC
Update Date2026-04-17 19:07:18 UTC
Accession NumberCHEM029286
Identification
Common NameHydrocyanite
ClassSmall Molecule
Description
Hydrocyanite is an inorganic compound with the chemical formula CuH10O9S and an average molecular weight of 249.69 g/mol. Hydrocyanite belongs to the transition metal sulfates, a subclass of transition metal oxoanionic compounds within the inorganic compounds. It is classified as a mixed metal/non-metal compound. Industrially, the compound is utilized as a biocide, as well as a flavouring and nutrient. Hydrocyanite is found in or released from 43 recorded sources. Within electrical and electronic equipment, it is associated with antennas, amplifiers, adjustable resistors, auxiliary devices, and coils, among 18 other items. It is present in building and construction materials, including roofs, ceilings, ladders, fencing, and stairs and ramps, as well as one other source. Household items such as watch chains also contain the compound. In the category of household cleaning and consumer products, it is found in bleaching agents, cigar cigarettes, pipe accessories, tobacco product moisture control, non electric simulated smoking devices, and one additional source. Furthermore, it is linked to food, food processing, and cookware, specifically in cellar tools, the preparation of vinegar, the preparation of wort, the preparation of wine or sparkling wine, and fermentation processes for beer, among two other sources. Literature supports inhalation as a route of exposure (PMC12202419).
Contaminant TypeNot Available
Chemical Structure
Synonyms
ValueSource
Copper sulphate(5.H2O)ChEBI
Copper(II) sulfate, pentahydrateChEBI
Copper(2+) sulfate (1:1) pentahydrateChEBI
Cupric sulfateChEBI
Cupric sulfate pentahydrateChEBI
CuSO4.5H2OChEBI
Copper sulfate(5.H2O)Generator
Copper sulfuric acid(5.H2O)Generator
Copper sulphuric acid(5.H2O)Generator
Copper(II) sulfuric acid, pentahydric acidGenerator
Copper(II) sulphate, pentahydrateGenerator
Copper(II) sulphuric acid, pentahydric acidGenerator
Copper(2+) sulfuric acid (1:1) pentahydric acidGenerator
Copper(2+) sulphate (1:1) pentahydrateGenerator
Copper(2+) sulphuric acid (1:1) pentahydric acidGenerator
Cupric sulfuric acidGenerator
Cupric sulphateGenerator
Cupric sulphuric acidGenerator
Cupric sulfuric acid pentahydric acidGenerator
Cupric sulphate pentahydrateGenerator
Cupric sulphuric acid pentahydric acidGenerator
Sulfate, cupricMeSH
Vitriol, blueMeSH
Blue vitriolMeSH
Sulfate, copperMeSH
Copper sulfateMeSH
Chemical FormulaCuH10O9S
Average Molecular Mass249.685 g/mol
Monoisotopic Mass248.934 g/mol
CAS Registry Number7758-99-8
IUPAC Namecopper(2+) ion pentahydrate sulfate
Traditional Namecopper(2+) ion pentahydrate sulfate
SMILESO.O.O.O.O.[Cu++].[O-]S([O-])(=O)=O
InChI IdentifierInChI=1S/Cu.H2O4S.5H2O/c;1-5(2,3)4;;;;;/h;(H2,1,2,3,4);5*1H2/q+2;;;;;;/p-2
InChI KeyJZCCFEFSEZPSOG-UHFFFAOYSA-L
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as transition metal sulfates. These are inorganic compounds in which the largest oxoanion is sulfate, and in which the heaviest atom not in an oxoanion is a transition metal.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassTransition metal oxoanionic compounds
Sub ClassTransition metal sulfates
Direct ParentTransition metal sulfates
Alternative Parents
Substituents
  • Transition metal sulfate
  • Inorganic copper salt
  • Inorganic oxide
  • Inorganic salt
Molecular FrameworkNot Available
External Descriptors
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 Properties
PropertyValueSource
logP-0.84ChemAxon
pKa (Strongest Acidic)-3ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count4ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area80.26 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity11.53 m³·mol⁻¹ChemAxon
Polarizability5.81 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-f7e33651534b29e8fb34Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-f7e33651534b29e8fb34Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-f7e33651534b29e8fb34Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-9c747941898ce6cc53f1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-9c747941898ce6cc53f1Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-0002-0090000000-9c747941898ce6cc53f1Not AvailableView Spectrum
Toxicity Profile
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity ValuesNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
233BrushesPersonal care & cosmeticsNot Available
495CeilingsBuilding & ConstructionNot Available
496FencingBuilding & ConstructionNot Available
498LaddersBuilding & ConstructionNot Available
499RoofsBuilding & ConstructionNot Available
500Stairs And RampsBuilding & ConstructionNot Available
503Tents Or CanopiesBuilding & ConstructionNot Available
504Adjustable ResistorsElectrical & Electronic EquipmentNot Available
505AmplifiersElectrical & Electronic EquipmentNot Available
506AntennasElectrical & Electronic EquipmentNot Available
507Auxiliary DevicesElectrical & Electronic EquipmentNot Available
508CoilsElectrical & Electronic EquipmentNot Available
509Colour Television SystemsElectrical & Electronic EquipmentNot Available
510Communication Cables Or ConductorsElectrical & Electronic EquipmentNot Available
513Cores Yokes Or ArmaturesElectrical & Electronic EquipmentNot Available
514Discharge LampsElectrical & Electronic EquipmentNot Available
516Electric Hearing AidsElectrical & Electronic EquipmentNot Available
517Electric SwitchesElectrical & Electronic EquipmentNot Available
518Electrically Stimulated Smoking DevicesElectrical & Electronic EquipmentNot Available
520Emergency Protective DevicesElectrical & Electronic EquipmentNot Available
521Fixed Capacitors And Their ManufactureElectrical & Electronic EquipmentNot Available
527MagnetsElectrical & Electronic EquipmentNot Available
528MicrophonesElectrical & Electronic EquipmentNot Available
529Power CablesElectrical & Electronic EquipmentNot Available
530Radio Transmission SystemsElectrical & Electronic EquipmentNot Available
535Superconducting Magnets And Superconducting CoilsElectrical & Electronic EquipmentNot Available
536Superconductive Or Hyperconductive Conductors Cables Or Transmission LinesElectrical & Electronic EquipmentNot Available
537Television SystemsElectrical & Electronic EquipmentNot Available
538Thin Magnetic FilmsElectrical & Electronic EquipmentNot Available
539Video GamesElectrical & Electronic EquipmentNot Available
543Cellar ToolsFood, food processing & cookwareNot Available
544Fermentation Processes For BeerFood, food processing & cookwareNot Available
548Preparation Of VinegarFood, food processing & cookwareNot Available
549Preparation Of Wine Or Sparkling WineFood, food processing & cookwareNot Available
550Preparation Of WortFood, food processing & cookwareNot Available
551Processing FishFood, food processing & cookwareNot Available
552Processing MeatsFood, food processing & cookwareNot Available
555Bleaching AgentsHousehold cleaning & consumer productsNot Available
556Cigar CigarettesHousehold cleaning & consumer productsNot Available
559Non Electric Simulated Smoking DevicesHousehold cleaning & consumer productsNot Available
562Pipe AccessoriesHousehold cleaning & consumer productsNot Available
568Tobacco Product Moisture ControlHousehold cleaning & consumer productsNot Available
569Tobacco Smoke FiltersHousehold cleaning & consumer productsNot Available
577Watch ChainsHousehold itemsNot Available
578Making CigarsIndustrial manufacturing & chemical processingNot Available
579Manufacture Of Iron Or SteelIndustrial manufacturing & chemical processingNot Available
581Paper Making MachinesIndustrial manufacturing & chemical processingNot Available
583Anchoring EquipmentMarine, shipping & aquacultureNot Available
589Life BuoysMarine, shipping & aquacultureNot Available
592Marine Propulsion Or SteeringMarine, shipping & aquacultureNot Available
597ChemosterilantsAgriculture & land managementNot Available
598Fertiliser DistributorsAgriculture & land managementNot Available
602MolluscicidesAgriculture & land managementNot Available
603NematocidesAgriculture & land managementNot Available
604Pest AttractantsAgriculture & land managementNot Available
605Pest RepellantsAgriculture & land managementNot Available
607Rodenticides(1)Agriculture & land managementNot Available
608RodenticidesAgriculture & land managementNot Available
609AftershavePersonal care & cosmeticsNot Available
617Lip Care ProductsPersonal care & cosmeticsNot Available
619Manicure PedicurePersonal care & cosmeticsNot Available
620Card GamesRecreation & sports surfacesNot Available
622Game AccessoriesRecreation & sports surfacesNot Available
627Roulette GamesRecreation & sports surfacesNot Available
630ToysRecreation & sports surfacesNot Available
633Azo DyesTextiles, leather & furnishingsNot Available
635ButtonsTextiles, leather & furnishingsNot Available
638Decorating TextilesTextiles, leather & furnishingsNot Available
640Embroidering And TuftingTextiles, leather & furnishingsNot Available
643HeadwearTextiles, leather & furnishingsNot Available
647Multicolour DyeingTextiles, leather & furnishingsNot Available
650Purses Luggage Hand BagsTextiles, leather & furnishingsNot Available
652RopesTextiles, leather & furnishingsNot Available
655Slide FastenersTextiles, leather & furnishingsNot Available
657Surface Finishing Of LeatherTextiles, leather & furnishingsNot Available
658Touch FastenersTextiles, leather & furnishingsNot Available
659Transfer PrintingTextiles, leather & furnishingsNot Available
661UmbrellasTextiles, leather & furnishingsNot Available
662Yarns Or ThreadsTextiles, leather & furnishingsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Carbonic anhydrase 2 structureClick to view 3D structureCarbonic anhydrase 2P00918HumansPredicted (SEA)3406.29
Carbonic anhydrase 7 structureClick to view 3D structureCarbonic anhydrase 7P43166HumansPredicted (SEA)2231.55
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)2998.75
Carbonic anhydrase 9 structureClick to view 3D structureCarbonic anhydrase 9Q16790HumansPredicted (SEA)3025.53
Click to view 3D structureAlpha carbonic anhydraseB5SU02Stylophora pistillataPredicted (SEA)180.999
Click to view 3D structureCarbonic anhydraseC0IX24Stylophora pistillataPredicted (SEA)180.999
Carbonic anhydrase 4 structureClick to view 3D structureCarbonic anhydrase 4P22748HumansPredicted (SEA)1970.13
Carbonic anhydrase 6 structureClick to view 3D structureCarbonic anhydrase 6P23280HumansPredicted (SEA)1557.92
Click to view 3D structureCarbonic anhydraseP40881Methanosarcina thermophilaPredicted (SEA)107.354
Click to view 3D structureAstrosclerin-3A6YCJ1Astrosclera willeyanaPredicted (SEA)298.396
Dual specificity protein phosphatase 5 structureClick to view 3D structureDual specificity protein phosphatase 5Q16690HumansPredicted (SEA)10.3539
Click to view 3D structureCarbonic anhydraseP53615Saccharomyces cerevisiae S288cPredicted (SEA)353.202
Click to view 3D structureCarbonic anhydrase 2P00921Bos taurusPredicted (SEA)508.511
Carbonic anhydrase 12 structureClick to view 3D structureCarbonic anhydrase 12O43570HumansPredicted (SEA)5581.79
Click to view 3D structureCarbonic anhydraseQ5AJ71Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast)Predicted (SEA)2069.08
Click to view 3D structureBeta-carbonic anhydrase 1P9WPJ7Mycobacterium tuberculosisPredicted (SEA)1617.32
Click to view 3D structureCarbonic anhydrase 2Q3I4V7Cryptococcus neoformansPredicted (SEA)2112.05
Click to view 3D structureCarbonic anhydrase 5B, mitochondrialQ9Y2D0HumansPredicted (SEA)3967.43
Click to view 3D structureDelta carbonic anhydraseQ5U9J1Conticribra weissflogiiPredicted (SEA)503.217
Click to view 3D structureCarbonic anhydraseQ6FTL6Candida glabrata CBS 138Predicted (SEA)1301.17
Click to view 3D structureCarbonate dehydrataseB2V8E3Sulfurihydrogenibium sp. (strain YO3AOP1)Predicted (SEA)609.637
Click to view 3D structureCarbonic anhydraseO24855Helicobacter pylori (strain ATCC 700392 / 26695) (Campylobacterpylori)Predicted (SEA)755.994
Click to view 3D structureCarbonic anhydrase, alpha familyQ31FD6Thiomicrospira crunogenaPredicted (SEA)609.715
Click to view 3D structureCarbonic anhydrase 15Q99N23Mus musculusPredicted (SEA)3325.87
Click to view 3D structureCarbonic anhydrase 5A, mitochondrialP35218HumansPredicted (SEA)5108.47
Concentrations
Not Available
External Links
DrugBank IDDBSALT002501
HMDB IDHMDB0035378
FooDB IDFDB014052
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkCopper(II)_sulfate
Chemspider IDNot Available
ChEBI ID31440
PubChem Compound ID24463
Kegg Compound IDNot Available
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. https://www.ncbi.nlm.nih.gov/pubmed/?term=11407502
2. https://www.ncbi.nlm.nih.gov/pubmed/?term=12209195
3. https://www.ncbi.nlm.nih.gov/pubmed/?term=12484481
4. https://www.ncbi.nlm.nih.gov/pubmed/?term=15040745
5. https://www.ncbi.nlm.nih.gov/pubmed/?term=15607472
6. https://www.ncbi.nlm.nih.gov/pubmed/?term=15824790
7. https://www.ncbi.nlm.nih.gov/pubmed/?term=19346702
8. https://www.ncbi.nlm.nih.gov/pubmed/?term=2002460
9. https://www.ncbi.nlm.nih.gov/pubmed/?term=20132934
10. https://www.ncbi.nlm.nih.gov/pubmed/?term=2913309
11. https://www.ncbi.nlm.nih.gov/pubmed/?term=3351847
12. https://www.ncbi.nlm.nih.gov/pubmed/?term=7615984
13. https://www.ncbi.nlm.nih.gov/pubmed/?term=8878264
14. https://www.ncbi.nlm.nih.gov/pubmed/?term=9521458
15. https://www.ncbi.nlm.nih.gov/pubmed/?term=9776063