Butyl glycol
2-Butoxyethanol
CAS 111-76-2 · C6H14O2 · MW 118.17 g/mol
About Butyl glycol
Butyl glycol is a chemical compound registered under number CAS 111-76-2, with the molecular formula C6H14O2, and a molar mass of 118.17 g/mol.
The molecule contains 22 atoms connected by 21 chemical bonds. The full systematic IUPAC name of this compound is 2-butoxyethanol. 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 = 0.8 (positive value, a lipophilic compound), polar surface area PSA = 29.5 Ų, 1 donors and 2 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
| Wzór sumaryczny | C6H14O2 |
| Masa molowa | 118.17 g/mol |
| IUPAC | 2-butoxyethanol |
| SMILES | CCCCOCCO |
| InChIKey | POAOYUHQDCAZBD-UHFFFAOYSA-N |
| logP (XLogP3) | 0.8 |
| PSA | 29.5 Ų |
| HBD / HBA | 1 / 2 |
| PubChem CID | CID 8133 ↗ |
GHS safety
Sygnał: Niebezpieczeństwo
H331 — Działa toksycznie w następstwie wdychania
H302 — Działa szkodliwie po połknięciu
H315 — Działa drażniąco na skórę
H319 — Działa drażniąco na oczy
Scientific literature
Literatura naukowa
20 artykułów · 10 open access · Źródła: PubMed, OpenAlex, Semantic Scholar
📈 Timeline publikacji (20 artykułów)
Wysokość słupka = liczba artykułów w roku. Hover dla szczegółów.
The German Senate Commission for the Investigation of Health Hazards of Chemical Compounds in the Work Area (MAK Commission) re-evaluated the assignment of 2-butoxyethanol to Pregnancy Risk Group C and it is confirmed that the assignment to Pregnancy Risk Group C has been confirmed.
Most of the changes in organ weights for rats and mice treated with the glycol ethers were sporadic (mice) or related to low final mean body weights (rats), except for thymic atrophy in male and female rats and testicularatrophy in males of both species receiving 2-methoxyethanol or 2-butoxy ethanol.
The primary effect on the hematopoietic system was an anemia characterized as macrocytic, normochromic, and regenerative in males exposed to 125 ppm or greater and, to a greater extent, in all exposed groups of females.
Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.
Synonyms
Data sources
- 📊 PubChem CID 8133 — NIH
- 🔬 NIST WebBook — spektroskopia
- 🌐 Wikidata
- 💊 ChEMBL — bioaktywność