6-chloro-1h-benzimidazole-2-carboxylic acid (CED0214735)

Record Information

Version

1.0

Creation Date

2026-08-24 20:30:49 UTC

Update Date

2026-08-24 20:30:49 UTC

SynCED ID

CED0214735

Secondary Accession Numbers

CHEM254617

Identification

Common Name

6-chloro-1h-benzimidazole-2-carboxylic acid

Class

Small Molecule

Description

6-chloro-1h-benzimidazole-2-carboxylic acid belongs to the benzimidazoles, a class of organoheterocyclic compounds within the organic compounds. This compound has the chemical formula C8H5ClN2O2 and an average molecular weight of 196.59 g/mol. It has been identified in or released from three recorded sources, which include video games, thin magnetic films, and auxiliary devices within electrical and electronic equipment.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₅ClN₂O₂

Average Molecular Mass

196.590 g/mol

Monoisotopic Mass

196.004 g/mol

CAS Registry Number

39811-14-8

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H5ClN2O2/c9-4-1-2-5-6(3-4)11-7(10-5)8(12)13/h1-3H,(H,10,11)(H,12,13)

InChI Key

NZIHMSYSZRFUQJ-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
2795.0 Log mg/kg [1600:5000]	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
CEDs000507	Auxiliary Devices?Auxiliary devices, such as capacitors, transformers, and circuit breakers, are integral components in various electronic systems.	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
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
CEDs000537	Television 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 Equipment	PubChem
CEDs000538	Thin Magnetic Films?Thin magnetic films are layers of magnetic material ranging from a few nanometers to several micrometers in thickness, commonly used in applications such as magnetic sensors, data storage devices, and electronic components.	Electrical & Electronic Equipment	PubChem
CEDs000539	Video Games?Video games, through their production and disposal processes, can be a source of synthetic chemical contamination.	Electrical & Electronic Equipment	PubChem
CEDs000606	Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.	Agriculture & land management	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
CEDs000692	Silica Free Oxide Glass?Silica Free Oxide Glass is a type of glass that is produced using alternative materials to traditional silica-based formulations.	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
CEDs000744	Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.	Wastewater, sanitation & biosolids	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	GTP-binding protein Rheb	Q15382	Humans	Predicted (SEA)	Prediction Confidence Score 0.34 Applicability Domain 0.34 Statistical Significance 1.00e-04 Supporting Reference Compounds 1 E-value 0.778492
Click to view 3D structure	Dual specificity tyrosine-phosphorylation-regulated kinase 1A	Q13627	Humans	Predicted (SEA)	Prediction Confidence Score 0.333 Applicability Domain 0.4 Statistical Significance 0.0488 Supporting Reference Compounds 906 E-value 380.138
Click to view 3D structure	Cyclin-dependent kinase 5	Q00535	Humans	Predicted (SEA)	Prediction Confidence Score 0.329 Applicability Domain 0.4 Statistical Significance 0.0462 Supporting Reference Compounds 779 E-value 359.663
Click to view 3D structure	RAC-alpha serine/threonine-protein kinase	P31749	Humans	Predicted (SEA)	Prediction Confidence Score 0.31 Applicability Domain 0.349 Statistical Significance 0.0716 Supporting Reference Compounds 797 E-value 557.478
Click to view 3D structure	RAC-beta serine/threonine-protein kinase	P31751	Humans	Predicted (SEA)	Prediction Confidence Score 0.31 Applicability Domain 0.349 Statistical Significance 0.0586 Supporting Reference Compounds 631 E-value 456.196
Click to view 3D structure	RAC-gamma serine/threonine-protein kinase	Q9Y243	Humans	Predicted (SEA)	Prediction Confidence Score 0.31 Applicability Domain 0.349 Statistical Significance 0.0582 Supporting Reference Compounds 620 E-value 453.238
Click to view 3D structure	Cyclin-dependent kinase 2	P24941	Humans	Predicted (SEA)	Prediction Confidence Score 0.308 Applicability Domain 0.32 Statistical Significance 0.0929 Supporting Reference Compounds 1029 E-value 723.453
Click to view 3D structure	Mitogen-activated protein kinase 1	P28482	Humans	Predicted (SEA)	Prediction Confidence Score 0.308 Applicability Domain 0.32 Statistical Significance 0.0739 Supporting Reference Compounds 763 E-value 575.306
Click to view 3D structure	Cytochrome P450 2C8	P10632	Humans	Predicted (SEA)	Prediction Confidence Score 0.308 Applicability Domain 0.4 Statistical Significance 0.0157 Supporting Reference Compounds 305 E-value 122.613
Click to view 3D structure	Serine/threonine-protein kinase N2	Q16513	Humans	Predicted (SEA)	Prediction Confidence Score 0.307 Applicability Domain 0.333 Statistical Significance 0.0625 Supporting Reference Compounds 567 E-value 486.558
Click to view 3D structure	Vascular endothelial growth factor receptor 2	P35968	Humans	Predicted (SEA)	Prediction Confidence Score 0.306 Applicability Domain 0.327 Statistical Significance 0.1337 Supporting Reference Compounds 1660 E-value 1040.92
Click to view 3D structure	Proto-oncogene tyrosine-protein kinase Src	P12931	Humans	Predicted (SEA)	Prediction Confidence Score 0.306 Applicability Domain 0.327 Statistical Significance 0.1055 Supporting Reference Compounds 1158 E-value 821.543
Click to view 3D structure	Cytochrome P450 3A4	P08684	Humans	Predicted (SEA)	Prediction Confidence Score 0.305 Applicability Domain 0.34 Statistical Significance 0.1488 Supporting Reference Compounds 1538 E-value 1158.32
Click to view 3D structure	Diacylglycerol O-acyltransferase 1	O75907	Humans	Predicted (SEA)	Prediction Confidence Score 0.304 Applicability Domain 0.4 Statistical Significance 0.0017 Supporting Reference Compounds 44 E-value 13.0008
Click to view 3D structure	Serine/threonine-protein kinase Chk2	O96017	Humans	Predicted (SEA)	Prediction Confidence Score 0.303 Applicability Domain 0.32 Statistical Significance 0.062 Supporting Reference Compounds 537 E-value 482.587
Click to view 3D structure	Hepatocyte growth factor receptor	P08581	Humans	Predicted (SEA)	Prediction Confidence Score 0.302 Applicability Domain 0.32 Statistical Significance 0.0985 Supporting Reference Compounds 934 E-value 766.659
Click to view 3D structure	Dual specificity protein kinase CLK1	P22518	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.301 Applicability Domain 0.4 Statistical Significance 0.0018 Supporting Reference Compounds 56 E-value 14.1686
Click to view 3D structure	Dual specificity protein kinase CLK4	Q9HAZ1	Humans	Predicted (SEA)	Prediction Confidence Score 0.3 Applicability Domain 0.32 Statistical Significance 0.0879 Supporting Reference Compounds 742 E-value 684.684
Click to view 3D structure	SRSF protein kinase 1	Q96SB4	Humans	Predicted (SEA)	Prediction Confidence Score 0.3 Applicability Domain 0.32 Statistical Significance 0.0644 Supporting Reference Compounds 486 E-value 501.115
Click to view 3D structure	Receptor-type tyrosine-protein kinase FLT3	P36888	Humans	Predicted (SEA)	Prediction Confidence Score 0.298 Applicability Domain 0.32 Statistical Significance 0.1412 Supporting Reference Compounds 1274 E-value 1099.54
Click to view 3D structure	Tyrosine-protein kinase ABL1	P00519	Humans	Predicted (SEA)	Prediction Confidence Score 0.297 Applicability Domain 0.327 Statistical Significance 0.1147 Supporting Reference Compounds 927 E-value 893.164
Click to view 3D structure	Cytochrome P450 2C9	P11712	Humans	Predicted (SEA)	Prediction Confidence Score 0.297 Applicability Domain 0.327 Statistical Significance 0.1452 Supporting Reference Compounds 1245 E-value 1130.45
Click to view 3D structure	D-amino-acid oxidase	P14920	Humans	Predicted (SEA)	Prediction Confidence Score 0.297 Applicability Domain 0.325 Statistical Significance 9.40e-04 Supporting Reference Compounds 32 E-value 7.31783
Click to view 3D structure	Fibroblast growth factor receptor 1	P11362	Humans	Predicted (SEA)	Prediction Confidence Score 0.295 Applicability Domain 0.32 Statistical Significance 0.1217 Supporting Reference Compounds 1010 E-value 947.347
Click to view 3D structure	Serine/threonine-protein kinase PAK 4	O96013	Humans	Predicted (SEA)	Prediction Confidence Score 0.295 Applicability Domain 0.32 Statistical Significance 0.097 Supporting Reference Compounds 728 E-value 755.527