2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid

Basic Information

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CAS Number

5001-96-7

Molecular Formula

C14H11FO2

Molecular Weight

230.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

140-142°C

Boiling Point

375.695°C at 760 mmHg

Density

1.235

Flash Point

181.014°C

Refractive Index

1.579

SMILES

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C1=CC=C(C=C1)C2=C(C=C(C=C2)CC(=O)O)F

InChI

InChI=1S/C14H11FO2/c15-13-8-10(9-14(16)17)6-7-12(13)11-4-2-1-3-5-11/h1-8H,9H2,(H,16,17)

InChIKey

ZLLZRKQQNGBXRD-UHFFFAOYSA-N

LogP

3.1198000000000015

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

261

Synonyms & References

English

2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid
(2-Fluoro-4-biphenyl)acetic Acid
2-(2-fluorobiphenyl-4-yl)acetic acid
2-(3-fluoro-4-phenylphenyl)acetic acid
2-Fluor-4-biphenylylessigsaeure
2-Fluoro-4-biphenylacetic Acid
3-Fluorbiphenylessigsaeure
Desmethylflurbiprofen
(2-Fluorobiphenyl-4-Yl)acetic Acid
2-Fluorobiphenyl-4-acetic acid
[1,1'-Biphenyl]-4-acetic acid, 2-fluoro-
2-{2-fluoro-[1,1'-biphenyl]-4-yl}acetic acid
Des-methylflurbiprofen
ZLLZRKQQNGBXRD-UHFFFAOYSA-N
2-Fluoro-4-biphenylylacetic Acid
BDBM50392945
{2-FLUORO-[1,1'-BIPHENYL]-4-YL}ACETIC ACID
2-Fluoro-4-biphenylylacetic Acid; 2-Fluoro-4-biphenylacetic Acid; 2-Fluoro-[1,1'-Biphenyl]-4-acetic Acid;
(2-Fluoro-biphenyl-4-yl)-acetic acid
2-(2-fluoro-[1,1'-biphenyl]-4-yl)acetic acid? (Flurbiprofen Impurity pound(c)
2-(2-Fluoro-[1 pound not1'-biphenyl]-4-yl)acetic acid
AKOS016007533
DS-2586
Q27459196
CHEMBL2152245
AMY14455
5001-96-7
SCHEMBL538938
CS-0164182
2-(3-fluoro-4-phenyl-phenyl)acetic Acid
A871684

MDL Number

MFCD09840622

Customs Code

2916399090

FAQ

What are the physical and chemical properties of 2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7)?

2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7) is a crystalline solid with a molecular weight of approximately 313.21 g/mol. It has a low water solubility and limited reactivity under normal conditions. The compound is stable towards hydrolysis and oxidation, but care should be taken in acidic or basic environments. It is soluble in common organic solvents such as ethanol and dichloromethane.

How is 2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7) typically synthesized?

2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7) can be synthesized via a multi-step process starting from 4-fluoro-[1,1'-biphenyl] and acetic anhydride. The key steps involve coupling reactions, acetylation, and purification. Common catalysts include triphenylphosphine. The overall yield is moderate, around 60-70%, with high chemical selectivity.

What industries use 2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7)?

2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7) is primarily used in the pharmaceutical industry for the synthesis of certain drug compounds. It also finds applications in polymer chemistry for the development of advanced materials and sensors. In electronics, the compound is used in the manufacturing of semiconductors due to its unique chemical properties.

What precautions should be taken when handling 2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7)?

When handling 2-(2-Fluoro-[1,1'-biphenyl]-4-yl)acetic acid (CAS: 5001-96-7), appropriate personal protective equipment (PPE) such as gloves, goggles, and a lab coat should be worn. The compound should be handled in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up immediately using appropriate absorbents, and proper disposal should follow local regulations. Refer to the Safety Data Sheet (SDS) for detailed handling and emergency procedures.