4-(4-Fluorobenzoyl)butyric Acid

CAS 149437-76-3  ·  C11H11FO3  ·  MW 210.20 g/mol

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3D model 4-(4-Fluorobenzoyl)butyric Acid, CAS 149437-76-3, molecular formula C11H11FO3, molar mass 210.20 g/mol
About 4-(4-Fluorobenzoyl)butyric Acid

4-(4-Fluorobenzoyl)butyric Acid is a chemical compound registered under number CAS 149437-76-3, with the molecular formula C11H11FO3, and a molar mass of 210.20 g/mol.

The molecule contains 26 atoms connected by 26 chemical bonds. The full systematic IUPAC name of this compound is 5-(4-fluorophenyl)-5-oxopentanoic acid. 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 = 1.8 (positive value, a lipophilic compound), polar surface area PSA = 54.4 Ų, 1 donors and 4 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 formulaC11H11FO3
Masa molowa210.20 g/mol
IUPAC5-(4-fluorophenyl)-5-oxopentanoic acid
SMILESC1=CC(=CC=C1C(=O)CCCC(=O)O)F
InChIKeyZBQROUOOMAMCQW-UHFFFAOYSA-N
logP (XLogP3)1.8
PSA54.4 Ų
HBD / HBA1 / 4
PubChem CIDCID 689096 ↗
GHS safety

Signal word: Warning

GHS09
GHS09

H411 — Działa toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

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

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

📈 Publication timeline (15 articles)

1988: 1 articles19881991: 1 articles2011: 1 articles2021: 2 articles2022: 1 articles20222024: 2 articles2025: 2 articles2026: 4 articles2026

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(2011) · Musing
Cytowania: 4$ PaywallDOI ↗

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

Synonyms
149437-76-3 · 4-(4-Fluorobenzoyl)butyric Acid · 4-Fluoro-delta-oxobenzenepentanoic Acid · RefChem:514192 · DTXCID80302115 · 604-692-0 · 5-(4-fluorophenyl)-5-oxopentanoic acid · MFCD00667222 · 4-Fluorophenyl-5'-oxobutyric Acid · 5-(4'-Fluorophenyl)-5-oxopentanoic acid · 4-(4-Fluorobenzoyl)butanoic acid · Oprea1_166432 · SCHEMBL296337 · Benzenepentanoic acid, 4-fluoro-delta-oxo- · 4-(4'-Fluorophenyl)butyric acid
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
4-(4-Fluorobenzoyl)butyric Acid — CAS 149437-76-3

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

MolGod License & Provenance Record:
4-(4-Fluorobenzoyl)butyric Acid (CAS 149437-76-3) — License & Provenance

Source:
4-(4-Fluorobenzoyl)butyric Acid (CAS 149437-76-3) — MolGod molecule record

Source data: PubChem CID 689096

STL: Download 3D model (528 KB)

SHA-256: 97abb87cef74661a32d421b8380c26ae9da6525b2bfe2e0384a57ab48ab380e3

Wikimedia Commons: not published yet

Source data: PubChem CID 689096

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