Ethylbenzene (CAS 100-41-4)

Ethylbenzene

CAS 100-41-4  ·  C8H10  ·  MW 106.16 g/mol

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3D model Ethylbenzene, CAS 100-41-4, molecular formula C8H10, molar mass 106.16 g/mol
About Ethylbenzene (CAS 100-41-4)

Ethylbenzene (CAS 100-41-4) is a chemical compound registered under number CAS 100-41-4, with the molecular formula C8H10, and a molar mass of 106.16 g/mol.

The molecule contains 18 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is ethylbenzene. 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 = 3.1 (positive value, a lipophilic compound), polar surface area PSA = 0 Ų, 0 donors and 0 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 formulaC8H10
Masa molowa106.16 g/mol
IUPACethylbenzene
SMILESCCC1=CC=CC=C1
InChIKeyYNQLUTRBYVCPMQ-UHFFFAOYSA-N
logP (XLogP3)3.1
PSA0 Ų
HBD / HBA0 / 0
PubChem CIDCID 7500 ↗
GHS safety

Signal word: Danger

GHS02
GHS02
GHS07
GHS07
GHS08
GHS08

H225 — Wysoce łatwopalna ciecz i pary

H332 — Działa szkodliwie w następstwie wdychania

H304 — Połknięcie i dostanie się przez drogi oddechowe może grozić śmiercią

H373 — Może powodować uszkodzenie narządów poprzez długotrwałe lub powtarzane narażenie

Scientific literature

Related literature

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

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

📈 Publication timeline (20 articles)

1992: 1 articles19921999: 1 articles2003: 1 articles2006: 1 articles2007: 1 articles2008: 1 articles2014: 1 articles20142015: 2 articles2021: 2 articles2023: 2 articles2025: 5 articles2026: 1 articles2026

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
ETHYLBENZENE · 100-41-4 · Phenylethane · Ethylbenzol · Benzene, ethyl- · Ethyl benzene · Ethylenzene · Aethylbenzol · Ethylbenzeen · Etilbenzene · Etylobenzen · alpha-Methyltoluene · NCI-C56393 · L5I45M5G0O · NSC-406903
Data sources
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License & Provenance

MolGod 3D molecular model
Ethylbenzene — CAS 100-41-4

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

MolGod License & Provenance Record:
Ethylbenzene (CAS 100-41-4) — License & Provenance

Source:
Ethylbenzene (CAS 100-41-4) — MolGod molecule record

Source data: PubChem CID 7500

STL: Download 3D model (366 KB)

SHA-256: f4a59fd10b1c96aedeebb7c852bf5c9c748caaa463e0095fcaa28833ce8a7779

Wikimedia Commons: not published yet

Source data: PubChem CID 7500

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