[4-(4-propylcyclohexyl)phenyl]boronic acid (CED0192324)

Record Information

Version

1.0

Creation Date

2026-08-19 12:18:32 UTC

Update Date

2026-08-19 12:18:32 UTC

SynCED ID

CED0192324

Secondary Accession Numbers

CHEM185844

Identification

Common Name

[4-(4-propylcyclohexyl)phenyl]boronic acid

Class

Small Molecule

Description

[4-(4-propylcyclohexyl)phenyl]boronic acid belongs to the benzene and substituted derivatives, a class of benzenoids within the organic compounds. This compound has the chemical formula C15H23BO2 and an average molecular weight of 246.15 g/mol. It has been identified in or released from two recorded sources: antennas and auxiliary devices within electrical and electronic equipment.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₁₅H₂₃BO₂

Average Molecular Mass

246.150 g/mol

Monoisotopic Mass

246.179 g/mol

CAS Registry Number

146862-02-4

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C15H23BO2/c1-2-3-12-4-6-13(7-5-12)14-8-10-15(11-9-14)16(17)18/h8-13,17-18H,2-7H2,1H3

InChI Key

QTBUVZSHCNAPRT-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
2688.0 Log mg/kg [1500:4800]	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
CEDs000010	Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.	Agriculture & land management	PubChem
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
CEDs000507	Auxiliary Devices?Auxiliary devices, such as capacitors, transformers, and circuit breakers, are integral components in various electronic systems.	Electrical & Electronic Equipment	PubChem
CEDs000545	Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.	Food, food processing & cookware	PubChem
CEDs000596	Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.	Agriculture & land management	PubChem
CEDs000603	Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and 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

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	Lipoprotein lipase	P06858	Humans	Predicted (SEA)	Prediction Confidence Score 0.341 Applicability Domain 0.4 Statistical Significance 2.00e-05 Supporting Reference Compounds 9 E-value 0.155698
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	Prediction Confidence Score 0.333 Applicability Domain 0.395 Statistical Significance 0.023 Supporting Reference Compounds 472 E-value 178.742
Click to view 3D structure	Fatty-acid amide hydrolase 1	P97612	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.323 Applicability Domain 0.375 Statistical Significance 0.0052 Supporting Reference Compounds 102 E-value 40.5594
Click to view 3D structure	Beta-lactamase	P00811	Escherichia coli (strain K12)	Predicted (SEA)	Prediction Confidence Score 0.321 Applicability Domain 0.353 Statistical Significance 2.80e-04 Supporting Reference Compounds 35 E-value 2.17978
Click to view 3D structure	Carbonic anhydrase	Q5AJ71	Candida albicans (strain SC5314 / ATCC MYA-2876) (Yeast)	Predicted (SEA)	Prediction Confidence Score 0.314 Applicability Domain 0.395 Statistical Significance 0.0054 Supporting Reference Compounds 68 E-value 42.1943
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	Prediction Confidence Score 0.302 Applicability Domain 0.395 Statistical Significance 0.0364 Supporting Reference Compounds 407 E-value 283.76
Click to view 3D structure	O-acyltransferase	A0A8I3N393	Canis lupus familiaris	Predicted (SEA)	Prediction Confidence Score 0.298 Applicability Domain 0.298 Low confidence Statistical Significance 2.60e-04 Supporting Reference Compounds 1 E-value 2.02408
Click to view 3D structure	Subtilisin BL	P29599	Bacillus lentus	Predicted (SEA)	Prediction Confidence Score 0.272 Applicability Domain 0.353 Statistical Significance 3.00e-05 Supporting Reference Compounds 2 E-value 0.233548
Click to view 3D structure	D(2) dopamine receptor	P14416	Humans	Predicted (SEA)	Prediction Confidence Score 0.27 Applicability Domain 0.326 Statistical Significance 0.1815 Supporting Reference Compounds 1103 E-value 1412.96
Click to view 3D structure	Diacylglycerol O-acyltransferase 1	O75907	Humans	Predicted (SEA)	Prediction Confidence Score 0.263 Applicability Domain 0.298 Low confidence Statistical Significance 0.0086 Supporting Reference Compounds 44 E-value 67.2617
Click to view 3D structure	Diacylglycerol O-acyltransferase 1	Q9Z2A7	Mus musculus	Predicted (SEA)	Prediction Confidence Score 0.259 Applicability Domain 0.298 Low confidence Statistical Significance 0.0031 Supporting Reference Compounds 19 E-value 24.4447
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q9R0C9	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.257 Applicability Domain 0.319 Statistical Significance 0.0661 Supporting Reference Compounds 207 E-value 514.661
Click to view 3D structure	D(2) dopamine receptor	P61169	Rat	Predicted (SEA)	Prediction Confidence Score 0.256 Applicability Domain 0.289 Low confidence Statistical Significance 0.1472 Supporting Reference Compounds 528 E-value 1146.17
Click to view 3D structure	Sterol O-acyltransferase 2	O75908	Humans	Predicted (SEA)	Prediction Confidence Score 0.254 Applicability Domain 0.298 Low confidence Statistical Significance 0.0022 Supporting Reference Compounds 19 E-value 17.1268
Click to view 3D structure	Transient receptor potential cation channel subfamily V member 1	Q8NER1	Humans	Predicted (SEA)	Prediction Confidence Score 0.251 Applicability Domain 0.375 Statistical Significance 0.0482 Supporting Reference Compounds 104 E-value 374.922
Click to view 3D structure	Autotaxin	Q13822	Humans	Predicted (SEA)	Prediction Confidence Score 0.251 Applicability Domain 0.324 Statistical Significance 0.0058 Supporting Reference Compounds 40 E-value 45.3861
Click to view 3D structure	D(3) dopamine receptor	P35462	Humans	Predicted (SEA)	Prediction Confidence Score 0.249 Applicability Domain 0.259 Low confidence Statistical Significance 0.2637 Supporting Reference Compounds 861 E-value 2052.73
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	Prediction Confidence Score 0.246 Applicability Domain 0.264 Low confidence Statistical Significance 0.2405 Supporting Reference Compounds 562 E-value 1872.2
Click to view 3D structure	D(4) dopamine receptor	P21917	Humans	Predicted (SEA)	Prediction Confidence Score 0.245 Applicability Domain 0.259 Low confidence Statistical Significance 0.2294 Supporting Reference Compounds 524 E-value 1786.09
Click to view 3D structure	5-hydroxytryptamine receptor 1A	P19327	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.243 Applicability Domain 0.289 Low confidence Statistical Significance 0.2282 Supporting Reference Compounds 541 E-value 1776.29
Click to view 3D structure	Sodium-dependent dopamine transporter	P23977	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.239 Applicability Domain 0.319 Statistical Significance 0.0947 Supporting Reference Compounds 203 E-value 737.154
Click to view 3D structure	Diacylglycerol O-acyltransferase 1	Q9ERM3	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.236 Applicability Domain 0.298 Low confidence Statistical Significance 8.00e-04 Supporting Reference Compounds 8 E-value 6.22794
Click to view 3D structure	D(3) dopamine receptor	P19020	Rattus norvegicus	Predicted (SEA)	Prediction Confidence Score 0.235 Applicability Domain 0.289 Low confidence Statistical Significance 0.132 Supporting Reference Compounds 145 E-value 1027.38
Click to view 3D structure	Diacylglycerol O-acyltransferase 2	Q96PD7	Humans	Predicted (SEA)	Prediction Confidence Score 0.235 Applicability Domain 0.298 Low confidence Statistical Significance 0.0088 Supporting Reference Compounds 24 E-value 68.8966
Click to view 3D structure	Voltage-gated inwardly rectifying potassium channel KCNH2	Q12809	Humans	Predicted (SEA)	Prediction Confidence Score 0.234 Applicability Domain 0.27 Low confidence Statistical Significance 0.7269 Supporting Reference Compounds 1498 E-value 5658.7