1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione (CED0175385)

Record Information
Version1.0
Creation Date2026-04-03 20:00:31 UTC
Update Date2026-04-03 20:00:31 UTC
Accession NumberCHEM067793
Identification
Common Name1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione
ClassSmall Molecule
Description
1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione is an organoheterocyclic compound with the formula C20H28N2O4 and an average molecular weight of 360.45 g/mol. 1,1'-(Dodecane-1,12-diyl)bis-1H-pyrrole-2,5-dione belongs to the pyrrolidones, a subclass of pyrrolidines within the organic compounds. This substance is found in or released from two recorded sources, which include electrical and electronic equipment such as superconducting magnets, superconducting coils, and antennas.
Contaminant TypeNot Available
Chemical Structure
MOLSDFPDBSMILESInChI
SynonymsNot Available
Chemical FormulaC20H28N2O4
Average Molecular Mass360.454 g/mol
Monoisotopic Mass360.205 g/mol
CAS Registry Number27574-80-7
IUPAC NameNot Available
Traditional NameNot Available
SMILESO=C1C=CC(=O)N1CCCCCCCCCCCCN1C(=O)C=CC1=O
InChI IdentifierInChI=1S/C20H28N2O4/c23-17-11-12-18(24)21(17)15-9-7-5-3-1-2-4-6-8-10-16-22-19(25)13-14-20(22)26/h11-14H,1-10,15-16H2
InChI KeyOEUTXEVXKFXZPB-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
1129.0Log mg/kg[640:2000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
506AntennasElectrical & Electronic EquipmentNot Available
535Superconducting Magnets And Superconducting CoilsElectrical & Electronic EquipmentNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Monoglyceride lipase structureClick to view 3D structureMonoglyceride lipaseQ99685HumansPredicted (SEA)3.97031
Click to view 3D structureDNA damage-inducible transcript 3 proteinP35639Mus musculusPredicted (SEA)8.56341
X-box-binding protein 1 structureClick to view 3D structureX-box-binding protein 1P17861HumansPredicted (SEA)8.56341
G-protein coupled receptor 55 structureClick to view 3D structureG-protein coupled receptor 55Q9Y2T6HumansPredicted (SEA)12.6116
G-protein coupled receptor 35 structureClick to view 3D structureG-protein coupled receptor 35Q9HC97HumansPredicted (SEA)9.49761
Click to view 3D structureMonoglyceride lipaseQ8R431Rattus norvegicusPredicted (SEA)9.88685
Click to view 3D structureFatty-acid amide hydrolase 1P97612Rattus norvegicusPredicted (SEA)287.809
5-hydroxytryptamine receptor 7 structureClick to view 3D structure5-hydroxytryptamine receptor 7P34969HumansPredicted (SEA)1290.9
5-hydroxytryptamine receptor 1A structureClick to view 3D structure5-hydroxytryptamine receptor 1AP08908HumansPredicted (SEA)1878.58
Click to view 3D structure5-hydroxytryptamine receptor 1AP19327Rattus norvegicusPredicted (SEA)1301.17
Click to view 3D structureAcetylcholinesteraseO42275Electrophorus electricusPredicted (SEA)707.104
Click to view 3D structureAcetylcholinesteraseP37136Rattus norvegicusPredicted (SEA)326.577
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)2642.83
Acetylcholinesterase structureClick to view 3D structureAcetylcholinesteraseP22303HumansPredicted (SEA)1527.17
Click to view 3D structureD(2) dopamine receptorP61169RatPredicted (SEA)1543.52
Amine oxidase [flavin-containing] B structureClick to view 3D structureAmine oxidase [flavin-containing] BP27338HumansPredicted (SEA)1261.7
Cholinesterase structureClick to view 3D structureCholinesteraseP06276HumansPredicted (SEA)1140.02
Click to view 3D structureCholinesteraseP81908Equus caballusPredicted (SEA)1142.52
D(3) dopamine receptor structureClick to view 3D structureD(3) dopamine receptorP35462HumansPredicted (SEA)3322.68
Protein deacetylase HDAC6 structureClick to view 3D structureProtein deacetylase HDAC6Q9UBN7HumansPredicted (SEA)3514.97
5-hydroxytryptamine receptor 2A structureClick to view 3D structure5-hydroxytryptamine receptor 2AP28223HumansPredicted (SEA)4026.05
Click to view 3D structureButyrylcholinesteraseQ9JKC1Rattus norvegicusPredicted (SEA)250.207
Click to view 3D structureBeta LactamaseQ932Y6Pseudomonas aeruginosaPredicted (SEA)610.104
Muscarinic acetylcholine receptor M2 structureClick to view 3D structureMuscarinic acetylcholine receptor M2P08172HumansPredicted (SEA)2677.94
Toll-like receptor 9 structureClick to view 3D structureToll-like receptor 9Q9NR96HumansPredicted (SEA)797.799
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available