2,4,5-Trifluorophenylacetic acid

CAS 209995-38-0  ·  C8H5F3O2  ·  MW 190.12 g/mol

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3D model 2,4,5-Trifluorophenylacetic acid, CAS 209995-38-0, molecular formula C8H5F3O2, molar mass 190.12 g/mol
About 2,4,5-Trifluorophenylacetic acid

2,4,5-Trifluorophenylacetic acid is a chemical compound registered under number CAS 209995-38-0, with the molecular formula C8H5F3O2, and a molar mass of 190.12 g/mol.

The molecule contains 18 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is 2-(2,4,5-trifluorophenyl)acetic 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 = 1.7 (positive value, a lipophilic compound), polar surface area PSA = 37.3 Ų, 1 donors and 5 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 formulaC8H5F3O2
Masa molowa190.12 g/mol
IUPAC2-(2,4,5-trifluorophenyl)acetic acid
SMILESC1=C(C(=CC(=C1F)F)F)CC(=O)O
InChIKeyYSQLGGQUQDTBSL-UHFFFAOYSA-N
logP (XLogP3)1.7
PSA37.3 Ų
HBD / HBA1 / 5
PubChem CIDCID 2777950 ↗
GHS safety

Signal word: Warning

GHS05
GHS05
GHS07
GHS07

H315 — Działa drażniąco na skórę

H318 — Powoduje poważne uszkodzenie oczu

H335 — Może powodować podrażnienie dróg oddechowych

H319 — Działa drażniąco na oczy

Scientific literature

Related literature

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

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

📈 Publication timeline (15 articles)

1921: 1 articles19212011: 2 articles2016: 1 articles20162022: 1 articles2026: 1 articles2026

Bar height = number of articles per year. Hover dla szczegółów.

(2011) · Musing
Cytowania: 1$ PaywallDOI ↗
(1878) · Agni
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.

Synonyms
2,4,5-Trifluorophenylacetic acid · 2-(2,4,5-trifluorophenyl)acetic Acid · (2,4,5-trifluorophenyl)acetic acid · RefChem:442784 · DTXCID80331748 · 466-070-3 · 606-684-2 · 209995-38-0 · Benzeneacetic acid, 2,4,5-trifluoro- · 2,4,5-Trifluorobenzeneacetic Acid · MFCD00082479 · 2,4,5-Trifluorophenylaceticacid · 2,4,5-Trifiuorophenylacetic acid · SCHEMBL332576 · (2,4,5-trifluorophenyl)-acetic acid
Data sources
Related molecules
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Model
2,4,5-Trifluorophenylacetic acid · 209995-38-0
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MolGod Scientific
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2,4,5-Trifluorophenylacetic acid →
Source data
PubChem CID 2777950 ↗
SHA-256 (STL)
6489544a1c88a26cf91fe95fa4f39509564d26ccee1bd4d47bee8b61797732af
Wikimedia Commons
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