alpha-Fluorophenylacetic acid - ≥97% , CAS No.1578-63-8

CAS: 1578-63-8 Cat. No.: A131766 Molecular Weight: 154.14 Beilstein Registry Number: 2087378 EC Number: 216-420-4
AVAILABLE TO ORDER
GRADE & PURITY ≥97%
Synonyms
2,5-DI(TERT-BUTYLPEROXIDE)HEXANE | FT-0622158 | ( )-2-Fluoro-2-phenylacetic acid | AKOS005207251 | Benzeneacetic acid, .alpha.-fluoro- | Fluoro(phenyl)acetic acid # | MFCD00004221 | STL554472 | SY109423 | NoName_860 | 2-Fluoro-2-phenylaceticacid | a-Fluor
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
250mg
A131766-250mg
5

$45.90

$68.90
Save $23.00 (33.38%)
1g
A131766-1g
2

$62.90

$94.90
Save $32.00 (33.72%)
5g
A131766-5g
2

$235.90

$353.90
Save $118.00 (33.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥97% 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, 5-DI(TERT-BUTYLPEROXIDE)HEXANE | FT-0622158 | ( )-2-Fluoro-2-phenylacetic acid | AKOS005207251 | Benzeneacetic acid, .alpha.-fluoro- | Fluoro(phenyl)acetic acid # | MFCD00004221 | STL554472 | SY109423 | NoName_860 | 2-Fluoro-2-phenylaceticacid | a-Fluor
Specifications & Purity
≥97%
Storage
Room temperature
Shipped In
Normal
Purity
≥97%
Names and Identifiers
Pubchem Sid488187309
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488187309
Canonical SmilesC1=CC=C(C=C1)C(C(=O)O)F
IUPAC Name2-fluoro-2-phenylacetic acid
InChIKeyATPPNMLQNZHDOG-UHFFFAOYSA-N
INCHI1S/C8H7FO2/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5,7H,(H,10,11)
Isomeric SMILES C1=CC=C(C=C1)C(C(=O)O)F
Molecular Weight 154.14
Beilstein 2087378
Reaxy-Rn 2087378
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2087378&ln=

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.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClassBenzene and substituted derivatives
SubclassNot available
Intermediate Tree Nodes Not available
Direct ParentBenzene and substituted derivatives
Alternative Parents Alpha-halocarboxylic acids  Monocarboxylic acids and derivatives  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Monocyclic benzene moiety - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Alkyl fluoride - Organohalogen compound - Organofluoride - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Aromatic homomonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
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.

7 results found

Lot NumberCertificate TypeDateItem
E2325495Certificate of AnalysisMar 04, 2025 A131766
E2325498Certificate of AnalysisMar 04, 2025 A131766
E2325503Certificate of AnalysisMar 04, 2025 A131766
E2325504Certificate of AnalysisMar 04, 2025 A131766
E2325512Certificate of AnalysisMar 04, 2025 A131766
E2325537Certificate of AnalysisMar 04, 2025 A131766
K2016155Certificate of AnalysisSep 14, 2022 A131766
Chemical and Physical Properties
Melt Point(°C)78-82°C
Molecular Weight154.140 g/mol
XLogP31.900
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass154.043 Da
Monoisotopic Mass154.043 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count11
Formal Charge0
Complexity141.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
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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