1,2-dimethylcyclohexan-1-amine (CED0213045)

Record Information

Version

1.0

Creation Date

2026-08-24 17:22:08 UTC

Update Date

2026-08-24 17:22:08 UTC

Accession Number

CHEM252471

Identification

Common Name

1,2-dimethylcyclohexan-1-amine

Class

Small Molecule

Description

1,2-dimethylcyclohexan-1-amine is an organic nitrogen compound with the chemical formula C8H17N and an average molecular weight of 127.23 g/mol. 1,2-dimethylcyclohexan-1-amine belongs to the cyclohexylamines, a subclass of organonitrogen compounds within the organic compounds. This compound is found in or released from five recorded sources. These sources include building and construction materials, specifically fencing and roofs, as well as electrical and electronic equipment, including power cables, antennas, and cores yokes or armatures.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₈H₁₇N

Average Molecular Mass

127.230 g/mol

Monoisotopic Mass

127.136 g/mol

CAS Registry Number

39077-52-6

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C8H17N/c1-7-5-3-4-6-8(7,2)9/h7H,3-6,9H2,1-2H3

InChI Key

KMLNXROOABNOMI-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

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
236.0	Log mg/kg	[130:420]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
496	Fencing	Building & Construction	Not Available
499	Roofs	Building & Construction	Not Available
506	Antennas	Electrical & Electronic Equipment	Not Available
513	Cores Yokes Or Armatures	Electrical & Electronic Equipment	Not Available
529	Power Cables	Electrical & Electronic Equipment	Not Available
579	Manufacture Of Iron Or Steel	Industrial manufacturing & chemical processing	Not Available
583	Anchoring Equipment	Marine, shipping & aquaculture	Not Available
584	Buoys	Marine, shipping & aquaculture	Not Available
589	Life Buoys	Marine, shipping & aquaculture	Not Available
631	Anthraquinone Dyes	Textiles, leather & furnishings	Not Available
640	Embroidering And Tufting	Textiles, leather & furnishings	Not Available
647	Multicolour Dyeing	Textiles, leather & furnishings	Not Available

Pathways

0 pathways

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	Abscisic acid 8'-hydroxylase 3	Q9FH76	Arabidopsis thaliana	Predicted (SEA)	0.233548
Click to view 3D structure	Spermidine synthase	Q6QA75	Sus scrofa	Predicted (SEA)	0.467095
Click to view 3D structure	Spermidine synthase	Q4CXJ6	Trypanosoma cruzi (strain CL Brener)	Predicted (SEA)	0.467095
Click to view 3D structure	Spermidine synthase	Q9NFS5	Plasmodium falciparum	Predicted (SEA)	0.467095
Click to view 3D structure	Sodium-dependent noradrenaline transporter	P23975	Humans	Predicted (SEA)	6053.32
Click to view 3D structure	Sodium-dependent serotonin transporter	P31645	Humans	Predicted (SEA)	6456.81
Click to view 3D structure	Sigma non-opioid intracellular receptor 1	Q99720	Humans	Predicted (SEA)	6484.3
Click to view 3D structure	Kappa-type opioid receptor	P41145	Humans	Predicted (SEA)	6654.01
Click to view 3D structure	Mu-type opioid receptor	P35372	Humans	Predicted (SEA)	6448.87
Click to view 3D structure	Delta-type opioid receptor	P41143	Humans	Predicted (SEA)	5933.67
Click to view 3D structure	Mu-type opioid receptor	P97266	Cavia porcellus	Predicted (SEA)	3380.91
Click to view 3D structure	Kappa-type opioid receptor	P41144	Cavia porcellus	Predicted (SEA)	3904.37
Click to view 3D structure	ANK_REP_REGION domain-containing protein	H0VJD1	Cavia porcellus	Predicted (SEA)	211.75
Click to view 3D structure	Sodium-dependent dopamine transporter	Q01959	Humans	Predicted (SEA)	7257.96
Click to view 3D structure	Serine/threonine-protein phosphatase 2A 65 kDa regulatory subunit A alpha isoform	Q76MZ3	Mus musculus	Predicted (SEA)	3.65891
Click to view 3D structure	Mu-type opioid receptor	P33535	Rattus norvegicus	Predicted (SEA)	4335.81
Click to view 3D structure	Cytochrome P450 2D6	P10635	Humans	Predicted (SEA)	7627.04
Click to view 3D structure	Histamine H4 receptor	Q9H3N8	Humans	Predicted (SEA)	6245.45
Click to view 3D structure	Histamine H2 receptor	P25021	Humans	Predicted (SEA)	7022.31
Click to view 3D structure	Sigma intracellular receptor 2	Q5BJF2	Humans	Predicted (SEA)	7267.07
Click to view 3D structure	Transient receptor potential cation channel subfamily A member 1	Q6RI86	Rattus norvegicus	Predicted (SEA)	3638.05
Click to view 3D structure	Matrix protein 2	P06821	Influenza A virus	Predicted (SEA)	0.467095
Click to view 3D structure	Muscarinic acetylcholine receptor M5	P08912	Humans	Predicted (SEA)	7047.53
Click to view 3D structure	5-hydroxytryptamine receptor 2A	P28223	Humans	Predicted (SEA)	7586.64
Click to view 3D structure	Muscarinic acetylcholine receptor M2	P08172	Humans	Predicted (SEA)	7411.64