Pentaethylenehexamine

CAS 4067-16-7  ·  C10H28N6  ·  MW 232.37 g/mol

Loading molecule...
3D model Pentaethylenehexamine, CAS 4067-16-7, molecular formula C10H28N6, molar mass 232.37 g/mol
About Pentaethylenehexamine

Pentaethylenehexamine is a chemical compound registered under number CAS 4067-16-7, with the molecular formula C10H28N6, and a molar mass of 232.37 g/mol.

The molecule contains 44 atoms connected by 43 chemical bonds. The full systematic IUPAC name of this compound is N'-[2-[2-[2-(2-aminoethylamino)ethylamino]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 = -3.4 (negative value, a hydrophilic compound), polar surface area PSA = 100 Ų, 6 donors and 6 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 formulaC10H28N6
Masa molowa232.37 g/mol
IUPACN'-[2-[2-[2-(2-aminoethylamino)ethylamino]ethylamino]ethyl]ethane-1,2-diamine
SMILESC(CNCCNCCNCCNCCN)N
InChIKeyLSHROXHEILXKHM-UHFFFAOYSA-N
logP (XLogP3)-3.4
PSA100 Ų
HBD / HBA6 / 6
PubChem CIDCID 19990 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07
GHS09
GHS09

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

H317 — Może powodować reakcję alergiczną skóry

H400 — Działa bardzo toksycznie na organizmy wodne

H410 — Działa bardzo toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

20 articles · 15 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (20 articles)

2012: 1 articles20122013: 1 articles2016: 1 articles2022: 1 articles20222023: 1 articles2026: 15 articles2026

Bar height = number of articles per year. Hover dla szczegółów.

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

Data sources
Related molecules
—
License & Provenance

MolGod 3D molecular model
Pentaethylenehexamine — CAS 4067-16-7

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

MolGod License & Provenance Record:
Pentaethylenehexamine (CAS 4067-16-7) — License & Provenance

Source:
Pentaethylenehexamine (CAS 4067-16-7) — MolGod molecule record

Source data: PubChem CID 19990

STL: Download 3D model (889 KB)

SHA-256: 079772f08718294a9a37bc7c36585baaba9c01c984244f218457db3a47098166

Wikimedia Commons: not published yet

Source data: PubChem CID 19990

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