2-Ethylhexyl Acetate

CAS 103-09-3  ·  C10H20O2  ·  MW 172.26 g/mol

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3D model 2-Ethylhexyl Acetate, CAS 103-09-3, molecular formula C10H20O2, molar mass 172.26 g/mol

Model views

  • 2-Ethylhexyl Acetate (CAS 103-09-3) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • 2-Ethylhexyl Acetate (CAS 103-09-3) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • 2-Ethylhexyl Acetate (CAS 103-09-3) – 2D structure, MolGod Viewer
    2D structure

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About 2-Ethylhexyl Acetate

2-Ethylhexyl Acetate is a chemical compound registered under number CAS 103-09-3, with the molecular formula C10H20O2, and a molar mass of 172.26 g/mol.

The molecule contains 32 atoms connected by 31 chemical bonds. The full systematic IUPAC name of this compound is 2-ethylhexyl acetate. 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 = 3.2 (positive value, a lipophilic compound), polar surface area PSA = 26.3 Ų, 0 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 interactive 3D model and the viewer images are protected by copyright (© MolGod.org) — terms of use: molgod.org/copyright/.

Physicochemical properties
Molecular formulaC10H20O2
Molar mass172.26 g/mol
IUPAC2-ethylhexyl acetate
SMILESCCCCC(CC)COC(=O)C
InChIKeyWOYWLLHHWAMFCB-UHFFFAOYSA-N
logP (XLogP3)3.2
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 7635 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Causes skin irritation

Scientific literature

Related literature

11 articles · 2 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filters:Export:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (number of articles: 11)

1979: number of articles 119792007: number of articles 22008: number of articles 42011: number of articles 120112012: number of articles 12015: number of articles 12024: number of articles 12024

Bar height = number of articles in a given year. Hover over a bar to see details.

Data from PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary generated by Semantic Scholar TLDR. Articles marked with require paid access.

Synonyms
2-ETHYLHEXYL ACETATE · 103-09-3 · Acetic acid, 2-ethylhexyl ester · 2-Ethyl-1-hexanol acetate · 2-Ethyl-1-hexyl acetate · 2-Ethylhexyl ethanoate · 2-Ethylhexanyl acetate · ethylhexyl acetate · beta-Ethylhexyl acetate · FEMA Number 2806 · Acetic acid alpha-ethylhexyl ester · 2C7K8OA8SB · NSC-8897 · DTXCID106694 · CHEBI:87392
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
2-Ethylhexyl Acetate · 103-09-3
InChIKey
WOYWLLHHWAMFCB-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — 2-Ethylhexyl Acetate (CAS 103-09-3)
License & provenance record
2-Ethylhexyl Acetate (CAS 103-09-3) →
MolGod molecule record
2-Ethylhexyl Acetate →
Source data
PubChem CID 7635 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
c64d66eb8208349ffd4aaf2e0475b2292e770f3ea8c56c7dea4ce20000ad8c0b
MD5 (STL)
71430d69d828f2de3688663b0d654fd2
MolGod Identification Number
MG_494-074-444-10
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
STL · PNG
Free printable molecule model
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This license applies to the MolGod-created STL mesh, not automatically to third-party source material.

This 3D model is also published on: Zenodo (DOI 10.5281/zenodo.24054181) · Wikimedia Commons
Included in datasets: Hugging Face · OSF project index
Source structure: PubChem (CID 7635)
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