N,N'-4-Phenylenedimaleimide (CED0035001)

Record Information

Version

1.0

Creation Date

2026-04-03 22:33:27 UTC

Update Date

2026-08-19 08:24:28 UTC

SynCED ID

CED0035001

Secondary Accession Numbers

CHEM068567

Identification

Common Name

N,N'-4-Phenylenedimaleimide

Class

Small Molecule

Description

N,N'-4-Phenylenedimaleimide is an organic compound with the formula C14H8N2O4 and an average molecular weight of 268.23 g/mol. N,N'-4-Phenylenedimaleimide belongs to the phenylpyrrolines, a subclass of pyrrolines within the organic compounds. This substance is classified as an organoheterocyclic compound. The compound has been identified in or released from four recorded sources, specifically within electrical and electronic equipment. These sources include antennas, coils, cores yokes or armatures, and superconducting magnets and superconducting coils.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₄H₈N₂O₄

Average Molecular Mass

268.228 g/mol

Monoisotopic Mass

268.048 g/mol

CAS Registry Number

3278-31-7

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

O=C1C=CC(=O)N1C1=CC=C(C=C1)N1C(=O)C=CC1=O

InChI Identifier

InChI=1S/C14H8N2O4/c17-11-5-6-12(18)15(11)9-1-2-10(4-3-9)16-13(19)7-8-14(16)20/h1-8H

InChI Key

AQGZJQNZNONGKY-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Not Available

Toxicity Profile

Toxicity Values

Toxicity Value	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Toxicity Rating	Reference
958.0 Log mg/kg [540:1700]	Rat	LD50	oral	predicted	Not Available	Not Available

Toxicity / Toxin Class

Not Available

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Health Effects

Health Effect	Relationship	Direction	Description	Reference

Exposure Sources

Source ID	Source	Sector	Reference
CEDs000506	Antennas?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 Equipment	PubChem
CEDs000508	Coils?Coils are components used in various electrical and electronic applications, such as transformers, inductors, and motors.	Electrical & Electronic Equipment	PubChem
CEDs000511	Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.	Electrical & Electronic Equipment	PubChem
CEDs000513	Cores Yokes Or Armatures?Cores, yokes, or armatures are components commonly found in electrical devices, used to facilitate the magnetic and electrical functions within motors, transformers, and generators.	Electrical & Electronic Equipment	PubChem
CEDs000519	Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.	Electrical & Electronic Equipment	PubChem
CEDs000521	Fixed Capacitors And Their Manufacture?Fixed capacitors are passive electronic components used to store and release electrical energy, playing a critical role in various circuits.	Electrical & Electronic Equipment	PubChem
CEDs000524	Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.	Electrical & Electronic Equipment	PubChem
CEDs000535	Superconducting Magnets And Superconducting Coils?Superconducting magnets and coils are utilized in various applications that require strong magnetic fields, such as magnetic resonance imaging (MRI) and particle accelerators.	Electrical & Electronic Equipment	PubChem
CEDs000632	Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.	Textiles, leather & furnishings	PubChem
CEDs000642	Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.	Textiles, leather & furnishings	PubChem
CEDs000652	Ropes?Ropes manufactured from synthetic fibers, such as polypropylene, nylon, and polyester, are widely used in various applications, including marine, construction, and outdoor activities.	Textiles, leather & furnishings	PubChem
CEDs000685	Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.	Building & Construction	PubChem
CEDs000693	Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.	Building & Construction	PubChem
CEDs000696	Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.	Industrial manufacturing & chemical processing	PubChem
CEDs000739	Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.	Paper, pulp & fiber products	PubChem
CEDs000740	Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.	Paper, pulp & fiber products	PubChem
CEDs000741	Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.	Paper, pulp & fiber products	PubChem

Pathways

0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Monoglyceride lipase	Q99685	Humans	Predicted (SEA)	Prediction Confidence Score 0.477 Applicability Domain 0.75 Statistical Significance 3.90e-04 Supporting Reference Compounds 76 E-value 3.03612
Click to view 3D structure	Histone acetyltransferase RTT109	Q07794	Saccharomyces cerevisiae (strain ATCC 204508 / S288c) (Baker's yeast)	Predicted (SEA)	Prediction Confidence Score 0.336 Applicability Domain 0.75 Statistical Significance 1.00e-04 Supporting Reference Compounds 17 E-value 0.778492
Click to view 3D structure	Large ribosomal subunit protein eL19A	P0CX82	Saccharomyces cerevisiae S288c	Predicted (SEA)	Prediction Confidence Score 0.335 Applicability Domain 0.625 Statistical Significance 9.00e-05 Supporting Reference Compounds 29 E-value 0.700643
Click to view 3D structure	Toll-like receptor 9	Q9NR96	Humans	Predicted (SEA)	Prediction Confidence Score 0.287 Applicability Domain 0.483 Statistical Significance 0.0062 Supporting Reference Compounds 111 E-value 48.4222
Click to view 3D structure	Glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase	Q9BHT9	Plasmodium berghei	Predicted (SEA)	Prediction Confidence Score 0.28 Applicability Domain 0.483 Statistical Significance 0.0042 Supporting Reference Compounds 105 E-value 32.3853
Click to view 3D structure	DNA dC->dU-editing enzyme APOBEC-3G	Q9HC16	Humans	Predicted (SEA)	Prediction Confidence Score 0.268 Applicability Domain 0.625 Statistical Significance 0.0019 Supporting Reference Compounds 76 E-value 14.9471
Click to view 3D structure	Fatty-acid amide hydrolase 1	P97612	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.249 Applicability Domain 0.6 Statistical Significance 0.0538 Supporting Reference Compounds 102 E-value 419.218
Click to view 3D structure	Heat shock factor protein 1	P38532	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.241 Applicability Domain 0.412 Statistical Significance 0.1032 Supporting Reference Compounds 166 E-value 803.638
Click to view 3D structure	DNA damage-inducible transcript 3 protein	P35639	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.234 Applicability Domain 0.333 Statistical Significance 0.158 Supporting Reference Compounds 226 E-value 1229.71
Click to view 3D structure	X-box-binding protein 1	P17861	Humans	Predicted (SEA)	Prediction Confidence Score 0.234 Applicability Domain 0.333 Statistical Significance 0.1582 Supporting Reference Compounds 227 E-value 1231.26
Click to view 3D structure	Replicase polyprotein 1ab	P0DTD1	SARS-CoV-2	Predicted (SEA)	Prediction Confidence Score 0.231 Applicability Domain 0.258 Low confidence Statistical Significance 0.1197 Supporting Reference Compounds 215 E-value 931.544
Click to view 3D structure	Liver carboxylesterase 1	P23141	Humans	Predicted (SEA)	Prediction Confidence Score 0.23 Applicability Domain 0.3 Statistical Significance 0.0273 Supporting Reference Compounds 55 E-value 212.373
Click to view 3D structure	Beta Lactamase	Q932Y6	Pseudomonas aeruginosa	Predicted (SEA)	Prediction Confidence Score 0.23 Applicability Domain 0.278 Low confidence Statistical Significance 0.0686 Supporting Reference Compounds 91 E-value 534.435
Click to view 3D structure	Short transient receptor potential channel 4	Q9QUQ5	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.229 Applicability Domain 0.412 Statistical Significance 0.1645 Supporting Reference Compounds 128 E-value 1281.01
Click to view 3D structure	Cholinesterase	P06276	Humans	Predicted (SEA)	Prediction Confidence Score 0.228 Applicability Domain 0.278 Low confidence Statistical Significance 0.2167 Supporting Reference Compounds 234 E-value 1687.38
Click to view 3D structure	Streptokinase A	P10520	Streptococcus pyogenes serotype M1	Predicted (SEA)	Prediction Confidence Score 0.227 Applicability Domain 0.269 Low confidence Statistical Significance 0.3053 Supporting Reference Compounds 425 E-value 2376.89
Click to view 3D structure	Amine oxidase [flavin-containing] A	P21397	Humans	Predicted (SEA)	Prediction Confidence Score 0.224 Applicability Domain 0.278 Low confidence Statistical Significance 0.2143 Supporting Reference Compounds 241 E-value 1668.31
Click to view 3D structure	Protoporphyrinogen oxidase, chloroplastic	Q9AR38	Oryza sativa subsp. japonica	Predicted (SEA)	Prediction Confidence Score 0.223 Applicability Domain 0.333 Statistical Significance 3.30e-04 Supporting Reference Compounds 2 E-value 2.56902
Click to view 3D structure	Pyruvate carboxylase	A0A0H3JRU9	Staphylococcus aureus (strain Mu50 / ATCC 700699)	Predicted (SEA)	Prediction Confidence Score 0.22 Applicability Domain 0.22 Low confidence Statistical Significance 0.0097 Supporting Reference Compounds 1 E-value 75.2802
Click to view 3D structure	Mannose-6-phosphate isomerase	P34949	Humans	Predicted (SEA)	Prediction Confidence Score 0.218 Applicability Domain 0.222 Low confidence Statistical Significance 0.0208 Supporting Reference Compounds 53 E-value 162.238
Click to view 3D structure	Cathepsin G	P08311	Humans	Predicted (SEA)	Prediction Confidence Score 0.217 Applicability Domain 0.435 Statistical Significance 0.083 Supporting Reference Compounds 55 E-value 646.149
Click to view 3D structure	Protein RecA	P9WHJ3	Mycobacterium tuberculosis	Predicted (SEA)	Prediction Confidence Score 0.214 Applicability Domain 0.222 Low confidence Statistical Significance 0.362 Supporting Reference Compounds 296 E-value 2817.91
Click to view 3D structure	Indoleamine 2,3-dioxygenase 1	P14902	Humans	Predicted (SEA)	Prediction Confidence Score 0.213 Applicability Domain 0.261 Low confidence Statistical Significance 0.1405 Supporting Reference Compounds 108 E-value 1094.02
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	Prediction Confidence Score 0.212 Applicability Domain 0.278 Low confidence Statistical Significance 0.4899 Supporting Reference Compounds 406 E-value 3814.07
Click to view 3D structure	L,D-transpeptidase 2	I6Y9J2	Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)	Predicted (SEA)	Prediction Confidence Score 0.212 Applicability Domain 0.212 Low confidence Statistical Significance 0.0035 Supporting Reference Compounds 1 E-value 27.4029