Trimethylhexane-1,6-diamine (CED0037442)

Record Information

Version

1.0

Creation Date

2026-04-05 00:36:54 UTC

Update Date

2026-08-25 16:07:21 UTC

Accession Number

CHEM086898

Identification

Common Name

Trimethylhexane-1,6-diamine

Class

Small Molecule

Description

Trimethylhexane-1,6-diamine is an organic nitrogen compound with the chemical formula C9H22N2 and an average molecular weight of 158.29 g/mol. Trimethylhexane-1,6-diamine belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This compound is associated with eight recorded sources from which it is found in or released. Within the category of electrical and electronic equipment, these sources include antennas, auxiliary devices, coils, contacts, and cores yokes or armatures, among one additional source. Furthermore, it is found in materials related to building and construction, specifically in fencing and ladders.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₉H₂₂N₂

Average Molecular Mass

158.289 g/mol

Monoisotopic Mass

158.178 g/mol

CAS Registry Number

25620-58-0

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1/C9H22N2/c1-8(9(2,3)11)6-4-5-7-10/h8H,4-7,10-11H2,1-3H3

InChI Key

HUXPKQXHDPXCMM-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
238.0	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
498	Ladders	Building & Construction	Not Available
506	Antennas	Electrical & Electronic Equipment	Not Available
507	Auxiliary Devices	Electrical & Electronic Equipment	Not Available
508	Coils	Electrical & Electronic Equipment	Not Available
512	Contacts	Electrical & Electronic Equipment	Not Available
513	Cores Yokes Or Armatures	Electrical & Electronic Equipment	Not Available
529	Power Cables	Electrical & Electronic Equipment	Not Available
582	Aircraft Carriers	Marine, shipping & aquaculture	Not Available
621	Chutes And Slides	Recreation & sports surfaces	Not Available
635	Buttons	Textiles, leather & furnishings	Not Available
638	Decorating Textiles	Textiles, leather & furnishings	Not Available
640	Embroidering And Tufting	Textiles, leather & furnishings	Not Available
643	Headwear	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	Thrombospondin-1	P07996	Humans	Predicted (SEA)	56.1293
Click to view 3D structure	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	469.664
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	2208.19
Click to view 3D structure	Spermine synthase	Q3SZA5	Bos taurus	Predicted (SEA)	0.544945
Click to view 3D structure	Mitochondrial 2-oxodicarboxylate carrier	Q8BZ09	Mus musculus	Predicted (SEA)	0.544945
Click to view 3D structure	Deoxyhypusine synthase	Q9GSW0	Plasmodium falciparum	Predicted (SEA)	18.2946
Click to view 3D structure	Lys-gingipain	B2RLK2	Porphyromonas gingivalis (strain ATCC 33277 / DSM 20709 / JCM 12257)	Predicted (SEA)	110.857
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	1442.47
Click to view 3D structure	UDP-N-acetylmuramoyl-tripeptide--D-alanyl-D-alanine ligase	Q5HMD9	Staphylococcus epidermidis (strain ATCC 35984 / RP62A)	Predicted (SEA)	29.1935
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	2630.53
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	1635.22
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	2054.21
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	1937.12
Click to view 3D structure	Sodium- and chloride-dependent GABA transporter 2	P31646	Rattus norvegicus	Predicted (SEA)	10.7432
Click to view 3D structure	Procathepsin L	P07711	Humans	Predicted (SEA)	2393.32
Click to view 3D structure	Cathepsin B	P07858	Humans	Predicted (SEA)	2443.3
Click to view 3D structure	Cathepsin K	P43235	Humans	Predicted (SEA)	2030.77
Click to view 3D structure	Pro-cathepsin H	P09668	Humans	Predicted (SEA)	447.944
Click to view 3D structure	Putative agmatine deiminase	Q8DW17	Streptococcus mutans serotype c (strain ATCC 700610 / UA159)	Predicted (SEA)	5.76084
Click to view 3D structure	Cathepsin S	P25774	Humans	Predicted (SEA)	2450.62
Click to view 3D structure	Glutathionylspermidine synthase	P90518	Crithidia fasciculata	Predicted (SEA)	147.291
Click to view 3D structure	RYamide receptor	P25931	Drosophila melanogaster	Predicted (SEA)	1.63483
Click to view 3D structure	Carboxypeptidase B2	Q96IY4	Humans	Predicted (SEA)	222.182
Click to view 3D structure	Sphingosine-1-phosphate lyase 1	Q8CHN6	Rattus norvegicus	Predicted (SEA)	21.5642
Click to view 3D structure	Isopentenyl-diphosphate Delta-isomerase 1	O35760	Rattus norvegicus	Predicted (SEA)	2.72472