N-(2-Hydroxyethyl)ethylenediamine

CAS 111-41-1  ·  C4H12N2O  ·  MW 104.15 g/mol

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3D model N-(2-Hydroxyethyl)ethylenediamine, CAS 111-41-1, molecular formula C4H12N2O, molar mass 104.15 g/mol
About N-(2-Hydroxyethyl)ethylenediamine

N-(2-Hydroxyethyl)ethylenediamine is a chemical compound registered under number CAS 111-41-1, with the molecular formula C4H12N2O, and a molar mass of 104.15 g/mol.

The molecule contains 19 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is 2-(2-aminoethylamino)ethanol. 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 = -1.7 (negative value, a hydrophilic compound), polar surface area PSA = 58.3 Ų, 3 donors and 3 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 formulaC4H12N2O
Masa molowa104.15 g/mol
IUPAC2-(2-aminoethylamino)ethanol
SMILESC(CNCCO)N
InChIKeyLHIJANUOQQMGNT-UHFFFAOYSA-N
logP (XLogP3)-1.7
PSA58.3 Ų
HBD / HBA3 / 3
PubChem CIDCID 8112 ↗
GHS safety

Signal word: Danger

GHS05
GHS05
GHS07
GHS07
GHS08
GHS08

? — H360Df

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

H317 — Może powodować reakcję alergiczną skóry

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

18 articles · 5 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (18 articles)

1961: 1 articles19612005: 1 articles2007: 2 articles2011: 1 articles2012: 2 articles2013: 1 articles2014: 1 articles2015: 1 articles20152017: 1 articles2020: 2 articles2021: 1 articles2022: 2 articles2023: 1 articles2024: 1 articles2024

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

Flavourings (2012) · EFSA journal. European Food Safety Authority
AI Summary
The CEF Panel concluded that the use of N-(2-aminoethylamino)ethanol in manufacturing of can coatings in direct contact with food does not raise a safety concern for the substance itself if migration does not exceed 0.05 mg/kg food.
Cytowania: 1Open AccessDOI ↗PubMed ↗PDF ↗

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

Synonyms
N-(2-Hydroxyethyl)ethylenediamine · monoethanol ethylenediamine · RefChem:112035 · 111-41-1 · 2-(2-Aminoethylamino)ethanol · Aminoethylethanolamine · 2-((2-Aminoethyl)amino)ethanol · N-(Hydroxyethyl)ethylenediamine · N-(2-Aminoethyl)ethanolamine · N-(Aminoethyl)ethanolamine · (2-Hydroxyethyl)ethylenediamine · Monoethanolethylenediamine · Ethanol, 2-[(2-aminoethyl)amino]- · (2-Aminoethyl)ethanolamine · 2-[(2-Aminoethyl)amino]ethanol
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
N-(2-Hydroxyethyl)ethylenediamine — CAS 111-41-1

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

MolGod License & Provenance Record:
N-(2-Hydroxyethyl)ethylenediamine (CAS 111-41-1) — License & Provenance

Source:
N-(2-Hydroxyethyl)ethylenediamine (CAS 111-41-1) — MolGod molecule record

Source data: PubChem CID 8112

STL: Download 3D model (381 KB)

SHA-256: 619145ffd0562f318c0cbed07fe5d50a6671d3ab07b63cd974dd1498f8fbed23

Wikimedia Commons: not published yet

Source data: PubChem CID 8112

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