Tetraethylenepentamine

CAS 112-57-2  ·  C8H23N5  ·  MW 189.30 g/mol

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3D model Tetraethylenepentamine, CAS 112-57-2, molecular formula C8H23N5, molar mass 189.30 g/mol
About Tetraethylenepentamine

Tetraethylenepentamine is a chemical compound registered under number CAS 112-57-2, with the molecular formula C8H23N5, and a molar mass of 189.30 g/mol.

The molecule contains 36 atoms connected by 35 chemical bonds. The full systematic IUPAC name of this compound is N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = -2.9 (negative value, a hydrophilic compound), polar surface area PSA = 88.1 Ų, 5 donors and 5 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC8H23N5
Masa molowa189.30 g/mol
IUPACN'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine
SMILESC(CNCCNCCNCCN)N
InChIKeyFAGUFWYHJQFNRV-UHFFFAOYSA-N
logP (XLogP3)-2.9
PSA88.1 Ų
HBD / HBA5 / 5
PubChem CIDCID 8197 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07
GHS09
GHS09

H312 — Działa szkodliwie w kontakcie ze skórą

H302 — Działa szkodliwie po połknięciu

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

H317 — Może powodować reakcję alergiczną skóry

H411 — Działa toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

1 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
TETRAETHYLENEPENTAMINE · 112-57-2 · Tetren · 1,4,7,10,13-Pentaazatridecane · Tetraethylene pentamine · Tetraethylpentylamine · 1,11-Diamino-3,6,9-triazaundecane · 3,6,9-Triazaundecamethylenediamine · DEH 26 · 3,6,9-Triazaundecane-1,11-diamine · Ancamine TEPA · TETRAEN · YZD1C9KQ28 · INSULCURE 9 · 1,2-Ethanediamine, N-(2-aminoethyl)-N'-[2-[(2-aminoethyl)amino]ethyl]-
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Tetraethylenepentamine — CAS 112-57-2

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
Tetraethylenepentamine (CAS 112-57-2) — License & Provenance

Source:
Tetraethylenepentamine (CAS 112-57-2) — MolGod molecule record

Source data: PubChem CID 8197

STL: Download 3D model (727 KB)

SHA-256: 3efade0b541daeaa87c015faeed9878a774999e712bd8f63987953f13588c8fa

Wikimedia Commons: not published yet

Source data: PubChem CID 8197

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.