2,4,6-Trifluorophenylacetic acid - ≥98% , CAS No.209991-63-9

CAS: 209991-63-9 Cat. No.: T122875 Molecular Weight: 190.12 EC Number: 642-863-1 PubChem CID: 2777951
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
2,4,6 trifluorophenyl acetic acid | 2,4,6-trifluorophenylacetic acid, AldrichCPR | DTXSID10380724 | AC-9795 | Benzeneacetic acid, 2,4,6-trifluoro- | 2,4,6-trifluorobenzeneacetic acid | A934212 | A21836 | NGEKZFHYZPHNKQ-UHFFFAOYSA-N | 2,4,6-Trifluorophenyl
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1g
T122875-1g
5

$30.90

$46.90
Save $16.00 (34.12%)
5g
T122875-5g
3

$79.90

$119.90
Save $40.00 (33.36%)
10g
T122875-10g
2

$143.90

$215.90
Save $72.00 (33.35%)
25g
T122875-25g
1

$314.90

$472.90
Save $158.00 (33.41%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms
2, 4, 6 trifluorophenyl acetic acid | 2, 4, 6-trifluorophenylacetic acid, AldrichCPR | DTXSID10380724 | AC-9795 | Benzeneacetic acid, 2, 4, 6-trifluoro- | 2, 4, 6-trifluorobenzeneacetic acid | A934212 | A21836 | NGEKZFHYZPHNKQ-UHFFFAOYSA-N | 2, 4, 6-Trifluorophenyl
Specifications & Purity
≥98%
Storage
Room temperature
Shipped In
Normal
Purity
≥98%
Names and Identifiers
Pubchem Sid488193760
Canonical SmilesC1=C(C=C(C(=C1F)CC(=O)O)F)F
IUPAC Name2-(2,4,6-trifluorophenyl)acetic acid
InChIKeyNGEKZFHYZPHNKQ-UHFFFAOYSA-N
INCHI1S/C8H5F3O2/c9-4-1-6(10)5(3-8(12)13)7(11)2-4/h1-2H,3H2,(H,12,13)
Isomeric SMILES C1=C(C=C(C(=C1F)CC(=O)O)F)F
PubChem CID 2777951
Molecular Weight 190.12

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassHalobenzenes
Intermediate Tree Nodes Not available
Direct ParentFluorobenzenes
Alternative Parents Aryl fluorides  Monocarboxylic acids and derivatives  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Fluorobenzene - Aryl halide - Aryl fluoride - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as fluorobenzenes. These are compounds containing one or more fluorine atoms attached to a benzene ring.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

13 results found

Lot NumberCertificate TypeDateItem
I2202064Certificate of AnalysisJun 11, 2026 T122875
I2202063Certificate of AnalysisJun 11, 2026 T122875
G2322878Certificate of AnalysisJul 03, 2023 T122875
G2322883Certificate of AnalysisJul 03, 2023 T122875
G2322886Certificate of AnalysisJul 03, 2023 T122875
G2322887Certificate of AnalysisJul 03, 2023 T122875
G2322894Certificate of AnalysisJul 03, 2023 T122875
G2324183Certificate of AnalysisJul 03, 2023 T122875
G2324191Certificate of AnalysisJul 03, 2023 T122875
E1528025Certificate of AnalysisFeb 08, 2023 T122875
E2323045Certificate of AnalysisJul 21, 2022 T122875
I2202068Certificate of AnalysisJul 21, 2022 T122875
I2202069Certificate of AnalysisJul 21, 2022 T122875

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Chemical and Physical Properties
Melt Point(°C)110-112°C
Molecular Weight190.120 g/mol
XLogP31.700
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass190.024 Da
Monoisotopic Mass190.024 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count13
Formal Charge0
Complexity186.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Solution Calculators
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