((6-Amino-1,3,5-triazine-2,4-diyl)diimino)bismethanol (CED0073246)

Record Information
Version1.0
Creation Date2026-04-04 02:17:32 UTC
Update Date2026-05-21 15:08:21 UTC
Accession NumberCHEM070649
Identification
Common Name((6-Amino-1,3,5-triazine-2,4-diyl)diimino)bismethanol
ClassSmall Molecule
Description
((6-Amino-1,3,5-triazine-2,4-diyl)diimino)bismethanol belongs to the aminotriazines, a subclass of triazines within the organic compounds. This organoheterocyclic compound has the formula C5H10N6O2 and an average molecular weight of 186.18 g/mol. It is found in or released from food contact materials used in food, food processing, and cookware, as well as gas filled discharge tubes with solid cathodes used in electrical and electronic equipment. Recorded exposure routes for this substance include oral, inhalation, and touch.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC5H10N6O2
Average Molecular Mass186.175 g/mol
Monoisotopic Mass186.087 g/mol
CAS Registry Number5001-80-9
IUPAC NameNot Available
Traditional NameNot Available
SMILESNC1=NC(NCO)=NC(NCO)=N1
InChI IdentifierInChI=1S/C5H10N6O2/c6-3-9-4(7-1-12)11-5(10-3)8-2-13/h12-13H,1-2H2,(H4,6,7,8,9,10,11)
InChI KeySUPOBRXPULIDDX-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
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
2448.0Log mg/kg[1400:4400]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
494Food contact materialsFood, food processing & cookwareNot Available
523Gas Filled Discharge Tubes With Solid CathodeElectrical & Electronic EquipmentNot Available
638Decorating TextilesTextiles, leather & furnishingsNot Available
652RopesTextiles, leather & furnishingsNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureAdenosine transporter 1Q9Y0I0Trypanosoma bruceiPredicted (SEA)0.467095
G-protein coupled receptor 68 structureClick to view 3D structureG-protein coupled receptor 68Q15743HumansPredicted (SEA)2.02408
5-hydroxytryptamine receptor 2B structureClick to view 3D structure5-hydroxytryptamine receptor 2BP41595HumansPredicted (SEA)1729.65
Adenosine receptor A2a structureClick to view 3D structureAdenosine receptor A2aP29274HumansPredicted (SEA)1227.99
Cyclin-dependent kinase 9 structureClick to view 3D structureCyclin-dependent kinase 9P50750HumansPredicted (SEA)3019.54
Dihydrofolate reductase structureClick to view 3D structureDihydrofolate reductaseP16184Pneumocystis cariniiPredicted (SEA)219.691
Click to view 3D structureDihydrofolate reductaseO30463Mycobacterium aviumPredicted (SEA)135.847
Click to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH3Q9ULD8HumansPredicted (SEA)91.8621
Dihydrofolate reductase structureClick to view 3D structureDihydrofolate reductaseP00374HumansPredicted (SEA)751.011
Click to view 3D structureBifunctional dihydrofolate reductase-thymidylate synthaseQ07422Toxoplasma gondiiPredicted (SEA)419.763
Ubiquitin-conjugating enzyme E2 B structureClick to view 3D structureUbiquitin-conjugating enzyme E2 BP63146HumansPredicted (SEA)71.5434
Click to view 3D structureChloroplast thylakoid membrane protein (psbA)Q31945Chenopodium albumPredicted (SEA)4.5931
Click to view 3D structureDihydrofolate reductaseQ920D2Rattus norvegicusPredicted (SEA)360.13
Click to view 3D structureHistamine H4 receptorQ91ZY1Rattus norvegicusPredicted (SEA)118.798
Dihydrofolate reductase structureClick to view 3D structureDihydrofolate reductaseP0ABQ4Escherichia coli (strain K12)Predicted (SEA)356.238
Dihydrofolate reductase structureClick to view 3D structureDihydrofolate reductaseP00381Lactobacillus caseiPredicted (SEA)376.946
Histamine H4 receptor structureClick to view 3D structureHistamine H4 receptorQ9H3N8HumansPredicted (SEA)1656.86
Tyrosine-protein kinase JAK2 structureClick to view 3D structureTyrosine-protein kinase JAK2O60674HumansPredicted (SEA)5801.4
Click to view 3D structurerRNA adenine N-6-methyltransferaseP21236Streptococcus pneumoniaePredicted (SEA)21.4864
Histamine H3 receptor structureClick to view 3D structureHistamine H3 receptorQ9Y5N1HumansPredicted (SEA)3094.27
Voltage-gated inwardly rectifying potassium channel KCNH2 structureClick to view 3D structureVoltage-gated inwardly rectifying potassium channel KCNH2Q12809HumansPredicted (SEA)7056.02
rRNA adenine N-6-methyltransferase structureClick to view 3D structurerRNA adenine N-6-methyltransferaseP13956Bacillus subtilisPredicted (SEA)34.098
Click to view 3D structureEukaryotic translation initiation factor 4 gamma 2Q62448Mus musculusPredicted (SEA)142.308
Click to view 3D structureATP-dependent molecular chaperone HSP82C4YTQ8Candida albicans (strain WO-1) (Yeast)Predicted (SEA)2973.84
Sentrin-specific protease 7 structureClick to view 3D structureSentrin-specific protease 7Q9BQF6HumansPredicted (SEA)2443.38
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available