3-Hexenyl isovalerate, (3Z)-

CAS 35154-45-1  ·  C11H20O2  ·  MW 184.27 g/mol

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3D model 3-Hexenyl isovalerate, (3Z)-, CAS 35154-45-1, molecular formula C11H20O2, molar mass 184.27 g/mol
About 3-Hexenyl isovalerate, (3Z)-

3-Hexenyl isovalerate, (3Z)- is a chemical compound registered under number CAS 35154-45-1, with the molecular formula C11H20O2, and a molar mass of 184.27 g/mol.

The molecule contains 33 atoms connected by 32 chemical bonds. The full systematic IUPAC name of this compound is [(Z)-hex-3-enyl] 3-methylbutanoate. 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 = 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 formulaC11H20O2
Masa molowa184.27 g/mol
IUPAC[(Z)-hex-3-enyl] 3-methylbutanoate
SMILESCC/C=C\CCOC(=O)CC(C)C
InChIKeyAIQLNKITFBJPFO-WAYWQWQTSA-N
logP (XLogP3)3.2
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 5367681 ↗
GHS safety

Signal word: Warning

GHS02
GHS02
Scientific literature

Related literature

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

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📈 Publication timeline (3 articles)

2004: 1 articles20042012: 1 articles20122021: 1 articles2021

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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
cis-3-Hexenyl isovalerate · (Z)-3-Hexenyl isovalerate · 35154-45-1 · [(Z)-hex-3-enyl] 3-methylbutanoate · cis-3-Hexenyl isopentanoate · (Z)-3-Hexen-1-yl isovalerate · (Z)-Hex-3-enyl isovalerate · (Z)-3-Hexenyl 3-methylbutyrate · 3-Hexenyl isopentanoate · Hex-3-enyl isovalerate · (Z)-Hex-3-enyl 3-methylbutanoate · Isovaleric acid, 3-hexenyl ester · cis-Hex-3-enyl 3-methylbutanoate · 3-Hexenyl 3-methylbutanoate · FEMA No. 3498
Data sources
Related molecules
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📜 License & provenanceMolGod_License_1
Model
3-Hexenyl isovalerate, (3Z)- · 35154-45-1
License
CC BY 4.0 International (source rights undetermined — not yet granted)
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MolGod Scientific
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Source data
PubChem CID 5367681 ↗
SHA-256 (STL)
769179f6a44cf1085a11bcaf396bf7b02b884f5cf928a952abfaf6a5d7c66cac
Wikimedia Commons
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