2,4-Bis(trifluoromethyl)phenylacetic acid - ≥97% , CAS No.177952-39-5

CAS: 177952-39-5 Cat. No.: B122842 Peso molecular: 272.15 Número EC: 671-626-5
Disponible para pedir
GRADE & PURITY ≥97%
Synonyms
2,4-ditrifluoromethylphenylacetic acid | 2,4-Bis(trifluoromethyl)phenylacetic acid | 2-[2,4-bis(trifluoromethyl)phenyl]acetic Acid | MFCD00042492 | Benzeneacetic acid, 2,4-bis(trifluoromethyl)- | [2,4-bis(trifluoromethyl)phenyl]acetic acid
Storage
Room temperature
Shipped In
Normal
 ·  off list, applied to all prices below.
Size
Estado
Price
Qty
250mg
B122842-250mg
5
21,90US$
1g
B122842-1g
4
67,90US$
5g
B122842-5g
5
246,90US$
10g
B122842-10g
4
389,90US$
Enter a quantity for the sizes you want to add.
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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

Sinónimos
2, 4-ditrifluoromethylphenylacetic acid | 2, 4-Bis(trifluoromethyl)phenylacetic acid | 2-[2, 4-bis(trifluoromethyl)phenyl]acetic Acid | MFCD00042492 | Benzeneacetic acid, 2, 4-bis(trifluoromethyl)- | [2, 4-bis(trifluoromethyl)phenyl]acetic acid
Especificaciones y pureza
≥97%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥97%
Nombres e identificadores
Pubchem Sid488192779
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488192779
Sonrisas canónicasC1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O
IUPAC Name2-[2,4-bis(trifluoromethyl)phenyl]acetic acid
InChIKeyBCHGLBXVODTIEE-UHFFFAOYSA-N
INCHI1S/C10H6F6O2/c11-9(12,13)6-2-1-5(3-8(17)18)7(4-6)10(14,15)16/h1-2,4H,3H2,(H,17,18)
Isómeros SMILES C1=CC(=C(C=C1C(F)(F)F)C(F)(F)F)CC(=O)O
Peso molecular 272.15
Reaxy-Rn 7818707
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7818707&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.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassTrifluoromethylbenzenes
Intermediate Tree Nodes Not available
Direct ParentTrifluoromethylbenzenes
Alternative Parents Monocarboxylic acids and derivatives  Carboxylic acids  Organofluorides  Organic oxides  Hydrocarbon derivatives  Carbonyl compounds  Alkyl fluorides  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Trifluoromethylbenzene - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organofluoride - Organohalogen compound - Carbonyl group - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as trifluoromethylbenzenes. These are organofluorine compounds that contain a benzene ring substituted with one or more trifluoromethyl groups.
External Descriptors Not available
Estructura 3D
Modelo de Estructura Química Interactiva





Certificados (CoA, COO, BSE/TSE y tabla de análisis)
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 TypeFechaArticulo
H2501221Certificate of AnalysisJul 21, 2025 B122842
H2501222Certificate of AnalysisJul 21, 2025 B122842
E2420156Certificate of AnalysisApr 23, 2024 B122842
E2420531Certificate of AnalysisApr 23, 2024 B122842
E2420541Certificate of AnalysisApr 23, 2024 B122842
G2312184Certificate of AnalysisJun 14, 2023 B122842
G2312185Certificate of AnalysisJun 14, 2023 B122842
G2312188Certificate of AnalysisJun 14, 2023 B122842
G2312189Certificate of AnalysisJun 14, 2023 B122842
G2312191Certificate of AnalysisJun 14, 2023 B122842
G2312192Certificate of AnalysisJun 14, 2023 B122842
G2312197Certificate of AnalysisJun 14, 2023 B122842
G2312200Certificate of AnalysisJun 14, 2023 B122842

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Propiedades químicas y físicas
Punto de fusión (°C)85-90°C
Peso molecular272.140 g/mol
XLogP33.200
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count2
Exact Mass272.027 Da
Monoisotopic Mass272.027 Da
Topological Polar Surface Area37.300 Ų
Heavy Atom Count18
Formal Charge0
Complexity308.000
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
Calculadoras de soluciones
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