Linuron (CAS 330-55-2)

Linuron

CAS 330-55-2  ·  C9H10Cl2N2O2  ·  MW 249.09 g/mol

Linuron (CAS 330-55-2) (CAS 330-55-2) — full MolGod record →
Safety data sheet with all sections: GHS classification, transport, regulatory status, spectra, 3D model and literature.
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3D model Linuron, CAS 330-55-2, molecular formula C9H10Cl2N2O2, molar mass 249.09 g/mol
About Linuron (CAS 330-55-2)

Linuron (CAS 330-55-2) is a chemical compound registered under number CAS 330-55-2, with the molecular formula C9H10Cl2N2O2, and a molar mass of 249.09 g/mol.

The molecule contains 25 atoms connected by 25 chemical bonds. The full systematic IUPAC name of this compound is 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea. 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 = 41.6 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
Molecular formulaC9H10Cl2N2O2
Molar mass249.09 g/mol
IUPAC3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea
SMILESCN(C(=O)NC1=CC(=C(C=C1)Cl)Cl)OC
InChIKeyXKJMBINCVNINCA-UHFFFAOYSA-N
logP (XLogP3)3.2
PSA41.6 Ų
HBD / HBA1 / 2
PubChem CIDCID 9502 ↗
GHS safety

Signal word: Danger

GHS07
GHS07
GHS08
GHS08
GHS09
GHS09

H351 — Suspected of causing cancer

? — H360Df

H302 — Harmful if swallowed

H373 — May cause damage to organs through prolonged or repeated exposure

H400 — Very toxic to aquatic life

H410 — Very toxic to aquatic life with long lasting effects

Scientific literature

Related literature

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

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

📈 Publication timeline (number of articles: 5)

1981: number of articles 119812022: number of articles 12024: number of articles 220242026: number of articles 12026

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
LINURON · 330-55-2 · 3-(3,4-Dichlorophenyl)-1-methoxy-1-methylurea · Afalon · Methoxydiuron · Cephalon · Aphalon · Linurex · Lorox · Afalon inuron · Herbicide 326 · Garnitan · Linorox · Rotalin · Sarclex
Data sources
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Related molecules
This 3D model is also published on: Zenodo (DOI 10.5281/zenodo.23277250) · NIH 3D (3DPX-023719) · Wikimedia Commons
Source structure: PubChem (CID 9502)
📜 License & provenanceMolGod_License_1
COMPUTED — PubChem3D · 3D conformer computed by PubChem using OMEGA; not an experimental structure.
Linuron (CAS 330-55-2), C9H10Cl2N2O2 - 3D ball-and-stick molecular model, engraved element symbols (C H Cl N O), MolGod STL previewDownload image

MG_290-797-782-17 · engraved · 336,820 △ · 16 MB · SHA-256 9e2bd9d17cf6f378

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Linuron (CAS 330-55-2), C9H10Cl2N2O2 - 3D ball-and-stick molecular model, MolGod STL previewDownload image

MG_290-797-782-17 · normal · 10,400 △ · 508 KB · SHA-256 047016ee4f10c021

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Model
Linuron · 330-55-2
InChIKey
XKJMBINCVNINCA-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Linuron (CAS 330-55-2)
License & provenance record
Linuron (CAS 330-55-2) →
MolGod molecule record
Linuron →
Source data
PubChem CID 9502 ↗
Model information
STL generated by MolGod · MolGod STL Exporter build 97d4498f28a7 · generated 2026-10-04
SHA-256 (STL)
047016ee4f10c021a01757ab846b350a6963c2d3ace585e0d5982a0b41aa651d
MD5 (STL)
980d3b5d877200c4bf8ba09353c89410
MolGod Identification Number
MG_290-797-782-17
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
STL · PNG

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

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