Ethyl 3,4-bis(2-methoxyethoxy)benzoate

CAS 183322-16-9  ·  C15H22O6  ·  MW 298.33 g/mol

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3D model Ethyl 3,4-bis(2-methoxyethoxy)benzoate, CAS 183322-16-9, molecular formula C15H22O6, molar mass 298.33 g/mol
About Ethyl 3,4-bis(2-methoxyethoxy)benzoate

Ethyl 3,4-bis(2-methoxyethoxy)benzoate is a chemical compound registered under number CAS 183322-16-9, with the molecular formula C15H22O6, and a molar mass of 298.33 g/mol.

The molecule contains 43 atoms connected by 43 chemical bonds. The full systematic IUPAC name of this compound is ethyl 3,4-bis(2-methoxyethoxy)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 (positive value, a lipophilic compound), polar surface area PSA = 63.2 Ų, 0 donors and 6 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 formulaC15H22O6
Masa molowa298.33 g/mol
IUPACethyl 3,4-bis(2-methoxyethoxy)benzoate
SMILESCCOC(=O)C1=CC(=C(C=C1)OCCOC)OCCOC
InChIKeyVGFZRAVMWXHEJB-UHFFFAOYSA-N
logP (XLogP3)2
PSA63.2 Ų
HBD / HBA0 / 6
PubChem CIDCID 2808992 ↗
Scientific literature

Related literature

14 articles · 3 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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(2011) · Musing
Cytowania: 1$ PaywallDOI ↗

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

Data sources
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Ethyl 3,4-bis(2-methoxyethoxy)benzoate · 183322-16-9
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Source data
PubChem CID 2808992 ↗
SHA-256 (STL)
6624e8222922686b7c4d533052550aad663fddde5473f73234fca3ef139cd81f
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