1,1,3-Triethoxy-2-methyl-butane

CAS 36551-27-6  ·  C11H24O3  ·  MW 204.31 g/mol

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3D model 1,1,3-Triethoxy-2-methyl-butane, CAS 36551-27-6, molecular formula C11H24O3, molar mass 204.31 g/mol
About 1,1,3-Triethoxy-2-methyl-butane

1,1,3-Triethoxy-2-methyl-butane is a chemical compound registered under number CAS 36551-27-6, with the molecular formula C11H24O3, and a molar mass of 204.31 g/mol.

The molecule contains 38 atoms connected by 37 chemical bonds. The full systematic IUPAC name of this compound is 1,1,3-triethoxy-2-methylbutane. 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 = 2.3 (positive value, a lipophilic compound), polar surface area PSA = 27.7 Ų, 0 donors and 3 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 formulaC11H24O3
Masa molowa204.31 g/mol
IUPAC1,1,3-triethoxy-2-methylbutane
SMILESCCOC(C)C(C)C(OCC)OCC
InChIKeyBWDYLUMZXQQYHK-UHFFFAOYSA-N
logP (XLogP3)2.3
PSA27.7 Ų
HBD / HBA0 / 3
PubChem CIDCID 11830544 ↗
Scientific literature

Related literature

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

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📈 Publication timeline (9 articles)

2004: 2 articles20042007: 2 articles2011: 1 articles2012: 1 articles20122013: 1 articles2023: 1 articles2023

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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
1,1,3-triethoxy-2-methyl-butane · 36551-27-6 · SCHEMBL7517448 · BWDYLUMZXQQYHK-UHFFFAOYSA-N · Butane, 1,1,3-triethoxy-2-methyl-
Data sources
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Model
1,1,3-Triethoxy-2-methyl-butane · 36551-27-6
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CC BY 4.0 International (source rights NIEUSTALONE — not yet granted)
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MolGod Scientific
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Source data
PubChem CID 11830544 ↗
SHA-256 (STL)
9848e81accf4a1fc51a62f025b8a0e10af5dc3107a127e2f7cca73076e8a38a6
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