Ethyl benzoate

CAS 93-89-0  ·  C9H10O2  ·  MW 150.17 g/mol

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3D model Ethyl benzoate, CAS 93-89-0, molecular formula C9H10O2, molar mass 150.17 g/mol
About Ethyl benzoate

Ethyl benzoate is a chemical compound registered under number CAS 93-89-0, with the molecular formula C9H10O2, and a molar mass of 150.17 g/mol.

The molecule contains 21 atoms connected by 21 chemical bonds. The full systematic IUPAC name of this compound is ethyl benzoate. 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 = 2.6 (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 widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC9H10O2
Masa molowa150.17 g/mol
IUPACethyl benzoate
SMILESCCOC(=O)C1=CC=CC=C1
InChIKeyMTZQAGJQAFMTAQ-UHFFFAOYSA-N
logP (XLogP3)2.6
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 7165 ↗
Scientific literature

Related literature

2 articles · 1 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (2 articles)

2018: 1 articles20182024: 1 articles2024

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

Synonyms
ETHYL BENZOATE · 93-89-0 · Benzoic ether · Ethyl benzenecarboxylate · Benzoic Acid Ethyl Ester · Benzoyl ethyl ether · Ethylester kyseliny benzoove · FEMA No. 2422 · Ethyl benzoate (natural) · NSC 8884 · EINECS 202-284-3 · UNII-J115BRJ15H · J115BRJ15H · AI3-01352 · NSC-8884
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Ethyl benzoate — CAS 93-89-0

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

MolGod License & Provenance Record:
Ethyl benzoate (CAS 93-89-0) — License & Provenance

Source:
Ethyl benzoate (CAS 93-89-0) — MolGod molecule record

Source data: PubChem CID 7165

STL: Download 3D model (427 KB)

SHA-256: 93c3c45502462a73a0b60ef5faae0cbd7ff14f36234af9d7235edd837afb32b2

Wikimedia Commons: not published yet

Source data: PubChem CID 7165

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