Propanal, 3-methoxy-

CAS 2806-84-0  ·  C4H8O2  ·  MW 88.11 g/mol

Full record: Propanal, 3-methoxy- — Safety Data Sheet →

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3D model Propanal, 3-methoxy-, CAS 2806-84-0, molecular formula C4H8O2, molar mass 88.11 g/mol

Model views

  • Propanal, 3-methoxy- (CAS 2806-84-0) – ball-and-stick 3D model, MolGod Viewer
    ball-and-stick 3D model
  • Propanal, 3-methoxy- (CAS 2806-84-0) – skeletal 3D model, MolGod Viewer
    skeletal 3D model
  • space-filling 3D model – rotation animation
  • Propanal, 3-methoxy- (CAS 2806-84-0) – 2D structure, MolGod Viewer
    2D structure

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About Propanal, 3-methoxy-

Propanal, 3-methoxy- is a chemical compound registered under number CAS 2806-84-0, with the molecular formula C4H8O2, and a molar mass of 88.11 g/mol.

The molecule contains 14 atoms connected by 13 chemical bonds. The full systematic IUPAC name of this compound is 3-methoxypropanal. 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 = -0.5 (negative value, a hydrophilic 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 formulaC4H8O2
Molar mass88.11 g/mol
IUPAC3-methoxypropanal
SMILESCOCCC=O
InChIKeyOXGJKCALURPRCN-UHFFFAOYSA-N
logP (XLogP3)-0.5
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 137720 ↗
GHS safety

Signal word: Danger

GHS02
GHS02
GHS07
GHS07

H225 — Highly flammable liquid and vapour

H302 — Harmful if swallowed

H315 — Causes skin irritation

H319 — Causes serious eye irritation

H335 — May cause respiratory irritation

Scientific literature

Brak articles naukowych dla CAS 2806-84-0 w PubMed / OpenAlex / Semantic Scholar.

Synonyms
2806-84-0 · Propanal, 3-methoxy- · RefChem:176262 · DTXCID80104833 · OXGJKCALURPRCN-UHFFFAOYSA-N · 3-Methoxypropanal · 3-METHOXY-PROPIONALDEHYDE · 3-Mehtoxypropionaldehyde · 3-methoxypropionaldehyde · MFCD08704314 · 3-Methoxy-propioldehyde · 3-Methoxy-propionaldehyde (Technical Grade) · 3-methoxy propanal · 3-Methoxypropanal # · 3-Methoxy propionaldehyde
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Model
Propanal, 3-methoxy- · 2806-84-0
InChIKey
OXGJKCALURPRCN-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Propanal, 3-methoxy- (CAS 2806-84-0)
License & provenance record
Propanal, 3-methoxy- (CAS 2806-84-0) →
MolGod molecule record
Propanal, 3-methoxy- →
Source data
PubChem CID 137720 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 48804cd20b0d · generated 2026-10-14
SHA-256 (STL)
474a9a755174fa26b57327c83ce470fdaf6934ba7c40b213fce7be16d78a7258
MD5 (STL)
37fdb38311ef4423a1e32220364ac3be
MolGod Identification Number
MG_783-487-686-09
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet
Free printable molecule model
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