Vinyl isobutyl ether

CAS 109-53-5  ·  C6H12O  ·  MW 100.16 g/mol

Full record: Vinyl isobutyl ether — Safety Data Sheet →

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3D model Vinyl isobutyl ether, CAS 109-53-5, molecular formula C6H12O, molar mass 100.16 g/mol

Model views

  • Vinyl isobutyl ether (CAS 109-53-5) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • Vinyl isobutyl ether (CAS 109-53-5) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • Vinyl isobutyl ether (CAS 109-53-5) – 2D structure, MolGod Viewer
    2D structure

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About Vinyl isobutyl ether

Vinyl isobutyl ether is a chemical compound registered under number CAS 109-53-5, with the molecular formula C6H12O, and a molar mass of 100.16 g/mol.

The molecule contains 19 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is 1-ethenoxy-2-methylpropane. 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 = 2.2 (positive value, a lipophilic compound), polar surface area PSA = 9.2 Ų, 0 donors and 1 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 interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC6H12O
Molar mass100.16 g/mol
IUPAC1-ethenoxy-2-methylpropane
SMILESCC(C)COC=C
InChIKeyOZCMOJQQLBXBKI-UHFFFAOYSA-N
logP (XLogP3)2.2
PSA9.2 Ų
HBD / HBA0 / 1
PubChem CIDCID 7992 ↗
GHS safety

Signal word: Danger

GHS02
GHS02
GHS07
GHS07

H225 — Highly flammable liquid and vapour

H315 — Causes skin irritation

H319 — Causes serious eye irritation

H412 — Harmful to aquatic life with long lasting effects

Scientific literature

Brak articles naukowych dla CAS 109-53-5 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
ISOBUTYL VINYL ETHER · 109-53-5 · Vinyl isobutyl ether · Propane, 1-(ethenyloxy)-2-methyl- · Isobutoxyethene · Ether, isobutyl vinyl · 1-(ethenyloxy)-2-methylpropane · Isobutanol vinyl ether · Lutanol LR 8500 · 2-Methyl-1-vinyloxypropane · Vinoflex MO 400* · NSC 8265 · Vinoflex MO 400 · iso-butyl vinyl ether · EINECS 203-678-8
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
Vinyl isobutyl ether · 109-53-5
InChIKey
OZCMOJQQLBXBKI-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Vinyl isobutyl ether (CAS 109-53-5)
License & provenance record
Vinyl isobutyl ether (CAS 109-53-5) →
MolGod molecule record
Vinyl isobutyl ether →
Source data
PubChem CID 7992 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
2488d7427b99573f808deaf020c036b4dc524c886b25ff876c7594b4fb15d8f7
MD5 (STL)
2396a9f49dffd09adf67bacb8ba895c3
MolGod Identification Number
MG_965-021-259-67
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet
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