1,3-dibromo-5-chlorobenzene (CED0037964)

Record Information

Version

1.0

Creation Date

2026-08-23 08:28:11 UTC

Update Date

2026-08-23 08:28:11 UTC

SynCED ID

CED0037964

Secondary Accession Numbers

CHEM229865

Identification

Common Name

1,3-dibromo-5-chlorobenzene

Class

Small Molecule

Description

1,3-dibromo-5-chlorobenzene belongs to the halobenzenes, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has the formula C6H3Br2Cl and an average molecular weight of 270.35 g/mol.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₆H₃Br₂Cl

Average Molecular Mass

270.350 g/mol

Monoisotopic Mass

267.829 g/mol

CAS Registry Number

14862-52-3

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C6H3Br2Cl/c7-4-1-5(8)3-6(9)2-4/h1-3H

InChI Key

FNKCOUREFBNNHG-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
259.0 Log mg/kg [150:460]	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
CEDs000688	Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.	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
CEDs03363	Organic Solar Cells	Electrical & Electronic Equipment	PMC13074071

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	Glutamine synthetase, chloroplastic	P25462	Zea mays	Predicted (SEA)	Prediction Confidence Score 0.233 Applicability Domain 0.233 Low confidence Statistical Significance 6.60e-04 Supporting Reference Compounds 1 E-value 5.13805
Click to view 3D structure	Proline--tRNA ligase, cytoplasmic	P78600	Candida albicans	Predicted (SEA)	Prediction Confidence Score 0.233 Applicability Domain 0.233 Low confidence Statistical Significance 0.0044 Supporting Reference Compounds 1 E-value 34.4872
Click to view 3D structure	Subtilisin BL	P29599	Bacillus lentus	Predicted (SEA)	Prediction Confidence Score 0.215 Applicability Domain 0.222 Low confidence Statistical Significance 1.20e-04 Supporting Reference Compounds 2 E-value 0.934191
Click to view 3D structure	Unconventional myosin-Va	Q02440	Gallus gallus	Predicted (SEA)	Prediction Confidence Score 0.212 Applicability Domain 0.212 Low confidence Statistical Significance 2.00e-04 Supporting Reference Compounds 1 E-value 1.55698
Click to view 3D structure	Myosin light chain kinase 2, skeletal/cardiac muscle	P07313	Oryctolagus cuniculus	Predicted (SEA)	Prediction Confidence Score 0.212 Applicability Domain 0.212 Low confidence Statistical Significance 2.00e-04 Supporting Reference Compounds 1 E-value 1.55698
Click to view 3D structure	5-hydroxytryptamine receptor 2B	P41595	Humans	Predicted (SEA)	Prediction Confidence Score 0.207 Applicability Domain 0.269 Low confidence Statistical Significance 0.7355 Supporting Reference Compounds 686 E-value 5726.04
Click to view 3D structure	Aryl hydrocarbon receptor	P35869	Humans	Predicted (SEA)	Prediction Confidence Score 0.203 Applicability Domain 0.238 Low confidence Statistical Significance 0.0902 Supporting Reference Compounds 42 E-value 702.278
Click to view 3D structure	Mitogen-activated protein kinase 14	Q16539	Humans	Predicted (SEA)	Prediction Confidence Score 0.2 Applicability Domain 0.269 Low confidence Statistical Significance 0.8174 Supporting Reference Compounds 668 E-value 6363.55
Click to view 3D structure	Mitogen-activated protein kinase 1	P28482	Humans	Predicted (SEA)	Prediction Confidence Score 0.2 Applicability Domain 0.269 Low confidence Statistical Significance 0.8317 Supporting Reference Compounds 763 E-value 6474.41
Click to view 3D structure	5-hydroxytryptamine receptor 2C	P28335	Humans	Predicted (SEA)	Prediction Confidence Score 0.2 Applicability Domain 0.269 Low confidence Statistical Significance 0.8073 Supporting Reference Compounds 823 E-value 6285.08
Click to view 3D structure	Tyrosine-protein kinase Lck	P06239	Humans	Predicted (SEA)	Prediction Confidence Score 0.198 Applicability Domain 0.269 Low confidence Statistical Significance 0.8939 Supporting Reference Compounds 1130 E-value 6959.33
Click to view 3D structure	Epidermal growth factor receptor	P00533	Humans	Predicted (SEA)	Prediction Confidence Score 0.198 Applicability Domain 0.269 Low confidence Statistical Significance 0.9022 Supporting Reference Compounds 1301 E-value 7023.48
Click to view 3D structure	Receptor tyrosine-protein kinase erbB-2	P04626	Humans	Predicted (SEA)	Prediction Confidence Score 0.196 Applicability Domain 0.269 Low confidence Statistical Significance 0.8344 Supporting Reference Compounds 674 E-value 6495.66
Click to view 3D structure	Vascular endothelial growth factor receptor 1	P17948	Humans	Predicted (SEA)	Prediction Confidence Score 0.193 Applicability Domain 0.238 Low confidence Statistical Significance 0.8556 Supporting Reference Compounds 711 E-value 6661.01
Click to view 3D structure	Streptokinase A	P10520	Streptococcus pyogenes serotype M1	Predicted (SEA)	Prediction Confidence Score 0.193 Applicability Domain 0.22 Low confidence Statistical Significance 0.6963 Supporting Reference Compounds 425 E-value 5420.88
Click to view 3D structure	Peptidyl-prolyl cis-trans isomerase A	P10111	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.189 Low confidence Statistical Significance 0.0581 Supporting Reference Compounds 1 E-value 452.226
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.189 Applicability Domain 0.208 Low confidence Statistical Significance 0.7014 Supporting Reference Compounds 472 E-value 5460.27
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	Prediction Confidence Score 0.188 Applicability Domain 0.269 Low confidence Statistical Significance 0.8848 Supporting Reference Compounds 861 E-value 6887.79
Click to view 3D structure	Dual specificity protein kinase CLK4	Q9HAZ1	Humans	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.2 Low confidence Statistical Significance 0.8995 Supporting Reference Compounds 742 E-value 7002.3
Click to view 3D structure	Solute carrier family 22 member 3	O75751	Humans	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.269 Low confidence Statistical Significance 0.013 Supporting Reference Compounds 17 E-value 100.893
Click to view 3D structure	Sodium-dependent dopamine transporter	Q01959	Humans	Predicted (SEA)	Prediction Confidence Score 0.187 Applicability Domain 0.269 Low confidence Statistical Significance 0.8775 Supporting Reference Compounds 506 E-value 6831.19
Click to view 3D structure	Alpha-2C adrenergic receptor	P18825	Humans	Predicted (SEA)	Prediction Confidence Score 0.186 Applicability Domain 0.269 Low confidence Statistical Significance 0.7917 Supporting Reference Compounds 386 E-value 6163.71
Click to view 3D structure	Cyclin-dependent kinase 5	Q00535	Humans	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.2 Low confidence Statistical Significance 0.9161 Supporting Reference Compounds 779 E-value 7131.46
Click to view 3D structure	Dual specificity tyrosine-phosphorylation-regulated kinase 1A	Q13627	Humans	Predicted (SEA)	Prediction Confidence Score 0.185 Applicability Domain 0.2 Low confidence Statistical Significance 0.9257 Supporting Reference Compounds 906 E-value 7206.58
Click to view 3D structure	Serine/threonine-protein kinase Chk1	O14757	Humans	Predicted (SEA)	Prediction Confidence Score 0.184 Applicability Domain 0.2 Low confidence Statistical Significance 0.9258 Supporting Reference Compounds 807 E-value 7206.97