1,7-Diaminoheptane (CED0010557)

Record Information

Version

1.0

Creation Date

2026-04-04 10:05:46 UTC

Update Date

2026-08-23 22:58:51 UTC

Accession Number

CHEM073437

Identification

Common Name

1,7-Diaminoheptane

Class

Small Molecule

Description

1,7-Diaminoheptane is an organic nitrogen compound with the chemical formula C7H18N2 and an average molecular weight of 130.24 g/mol. 1,7-Diaminoheptane belongs to the amines, a subclass of organonitrogen compounds within the organic compounds. This compound is associated with nine recorded sources across various sectors. Within electrical and electronic equipment, it is found in or released from antennas, coils, magnets, electric switches, and communication cables or conductors. In the building and construction sector, it is linked to floors. Additionally, the compound is identified in food, food processing, and cookware, specifically regarding the processing of meats and the preparation of wine or sparkling wine.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₇H₁₈N₂

Average Molecular Mass

130.235 g/mol

Monoisotopic Mass

130.147 g/mol

CAS Registry Number

646-19-5

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

NCCCCCCCN

InChI Identifier

InChI=1S/C7H18N2/c8-6-4-2-1-3-5-7-9/h1-9H2

InChI Key

PWSKHLMYTZNYKO-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
762.0	Log mg/kg	[430:1400]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
497	Floors	Building & Construction	Not Available
506	Antennas	Electrical & Electronic Equipment	Not Available
508	Coils	Electrical & Electronic Equipment	Not Available
510	Communication Cables Or Conductors	Electrical & Electronic Equipment	Not Available
517	Electric Switches	Electrical & Electronic Equipment	Not Available
527	Magnets	Electrical & Electronic Equipment	Not Available
529	Power Cables	Electrical & Electronic Equipment	Not Available
549	Preparation Of Wine Or Sparkling Wine	Food, food processing & cookware	Not Available
552	Processing Meats	Food, food processing & cookware	Not Available
602	Molluscicides	Agriculture & land management	Not Available
604	Pest Attractants	Agriculture & land management	Not Available
607	Rodenticides(1)	Agriculture & land management	Not Available
608	Rodenticides	Agriculture & land management	Not Available
630	Toys	Recreation & sports surfaces	Not Available
631	Anthraquinone Dyes	Textiles, leather & furnishings	Not Available
633	Azo Dyes	Textiles, leather & furnishings	Not Available
635	Buttons	Textiles, leather & furnishings	Not Available
652	Ropes	Textiles, leather & furnishings	Not Available
655	Slide Fasteners	Textiles, leather & furnishings	Not Available
656	Snap Fasteners	Textiles, leather & furnishings	Not Available
657	Surface Finishing Of Leather	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	Carbonic anhydrase 4	P22748	Humans	Predicted (SEA)	5.99439
Click to view 3D structure	Carbonic anhydrase 7	P43166	Humans	Predicted (SEA)	15.6477
Click to view 3D structure	Carbonic anhydrase 6	P23280	Humans	Predicted (SEA)	8.32987
Click to view 3D structure	Carbonic anhydrase 14	Q9ULX7	Humans	Predicted (SEA)	11.0546
Click to view 3D structure	Carbonic anhydrase 5B, mitochondrial	Q9Y2D0	Humans	Predicted (SEA)	8.40772
Click to view 3D structure	Carbonic anhydrase 5A, mitochondrial	P35218	Humans	Predicted (SEA)	9.03051
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	36.4334
Click to view 3D structure	Spermine synthase	Q3SZA5	Bos taurus	Predicted (SEA)	0.0778492
Click to view 3D structure	Mitochondrial 2-oxodicarboxylate carrier	Q8BZ09	Mus musculus	Predicted (SEA)	0.0778492
Click to view 3D structure	Deoxyhypusine synthase	Q9GSW0	Plasmodium falciparum	Predicted (SEA)	0.389246
Click to view 3D structure	Carbonic anhydrase 15	Q99N23	Mus musculus	Predicted (SEA)	14.3243
Click to view 3D structure	Sodium- and chloride-dependent GABA transporter 2	P31646	Rattus norvegicus	Predicted (SEA)	0.778492
Click to view 3D structure	Putative agmatine deiminase	Q8DW17	Streptococcus mutans serotype c (strain ATCC 700610 / UA159)	Predicted (SEA)	0.0778492
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	172.28
Click to view 3D structure	Carbonic anhydrase 13	Q9D6N1	Mus musculus	Predicted (SEA)	45.6196
Click to view 3D structure	Deoxyhypusine synthase	Q6AY53	Rattus norvegicus	Predicted (SEA)	0.467095
Click to view 3D structure	Carbonic anhydrase 3	P07451	Humans	Predicted (SEA)	98.635
Click to view 3D structure	Acetylpolyamine amidohydrolase	Q48935	Mycoplana ramosa	Predicted (SEA)	3.65891
Click to view 3D structure	Polyamine oxidase 1	O64411	Zea mays	Predicted (SEA)	4.5931
Click to view 3D structure	Isopentenyl-diphosphate Delta-isomerase 1	O35760	Rattus norvegicus	Predicted (SEA)	1.40129
Click to view 3D structure	Farnesyl pyrophosphate synthase	P05369	Rattus norvegicus	Predicted (SEA)	1.40129
Click to view 3D structure	Ornithine decarboxylase	P09057	Rattus norvegicus	Predicted (SEA)	0.0778492
Click to view 3D structure	Deoxyhypusine synthase	P49366	Humans	Predicted (SEA)	2.02408
Click to view 3D structure	Putative amino acid permease/transporter	D5FGE8	Trypanosoma cruzi	Predicted (SEA)	23.2769
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	3726.18