2,4,6-Trimethoxybenzaldehyde

CAS 830-79-5  ·  C10H12O4  ·  MW 196.20 g/mol

Loading molecule...
3D model 2,4,6-Trimethoxybenzaldehyde, CAS 830-79-5, molecular formula C10H12O4, molar mass 196.20 g/mol
About 2,4,6-Trimethoxybenzaldehyde

2,4,6-Trimethoxybenzaldehyde is a chemical compound registered under number CAS 830-79-5, with the molecular formula C10H12O4, and a molar mass of 196.20 g/mol.

The molecule contains 26 atoms connected by 26 chemical bonds. The full systematic IUPAC name of this compound is 2,4,6-trimethoxybenzaldehyde. 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 = 1.3 (positive value, a lipophilic compound), polar surface area PSA = 44.8 Ų, 0 donors and 4 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 formulaC10H12O4
Masa molowa196.20 g/mol
IUPAC2,4,6-trimethoxybenzaldehyde
SMILESCOC1=CC(=C(C(=C1)OC)C=O)OC
InChIKeyCRBZVDLXAIFERF-UHFFFAOYSA-N
logP (XLogP3)1.3
PSA44.8 Ų
HBD / HBA0 / 4
PubChem CIDCID 70019 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

15 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (15 articles)

1922: 1 articles19221934: 1 articles1977: 1 articles1980: 1 articles1985: 1 articles1993: 1 articles2002: 2 articles20022003: 2 articles2004: 1 articles2006: 1 articles2011: 1 articles2017: 1 articles2019: 1 articles2019

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

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

Synonyms
2,4,6-Trimethoxybenzaldehyde · Benzaldehyde, 2,4,6-trimethoxy- · JD365X6J84 · CRBZVDLXAIFERF-UHFFFAOYSA- · RefChem:82133 · DTXCID20154610 · 212-598-2 · 4-08-00-02717 (Beilstein Handbook Reference) · CRBZVDLXAIFERF-UHFFFAOYSA-N · 830-79-5 · MFCD00003313 · 2,4,6-Trimethoxybenzaldehyde, 98% · BBL027431 · ZB1376 · AC-12837
Data sources
Related molecules
—
License & Provenance

MolGod 3D molecular model
2,4,6-Trimethoxybenzaldehyde — CAS 830-79-5

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

MolGod License & Provenance Record:
2,4,6-Trimethoxybenzaldehyde (CAS 830-79-5) — License & Provenance

Source:
2,4,6-Trimethoxybenzaldehyde (CAS 830-79-5) — MolGod molecule record

Source data: PubChem CID 70019

STL: Download 3D model (528 KB)

SHA-256: 4a9886de6e8bff8f8a911d8b0b7a4b6ab2d19b5c2f43e2d4c5b4d30708a4b7ab

Wikimedia Commons: not published yet

Source data: PubChem CID 70019

This licence applies to the MolGod-created STL mesh, not automatically to third-party source material.