(3-Fluorophenyl)acetic acid

Basic Information

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CAS Number

331-25-9

Molecular Formula

C8H7FO2

Molecular Weight

154.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Melting Point

42-44 °C

Boiling Point

125°C/2.5mmHg

Water Solubility

Slightly soluble in chloroform and methanol. Insoluble in water.

SMILES

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C1=CC(=CC(=C1)F)CC(=O)O

InChI

InChI=1S/C8H7FO2/c9-7-3-1-2-6(4-7)5-8(10)11/h1-4H,5H2,(H,10,11)

InChIKey

YEAUYVGUXSZCFI-UHFFFAOYSA-N

LogP

1.4528

Topological Polar Surface Area

37.3 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

147

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

2-[(4-ETHOXYPHENYL)METHYL]HEXAHYDRO-1H-AZEPINE
(m-Fluorophenyl)acetic acid
Acetic acid, (m-fluorophenyl)-;Benzeneacetic acid, 3-fluoro-
2-(3-fluorophenyl)acetic acid
SY001712
A5915
DTXSID0059821
Z104486030
SCHEMBL9113
NCIOpen2_001447
3-Fluorophenylacetic acid, 98%
331-25-9
CHEMBL136104
AC-2510
BS-3850
NSC 88344
3-Fluorophenylaceticacid
3-Fluorophenyl acetic acid
AKOS000120663
UNII-4CP7BU47LD
Acetic acid, (3-fluorophenyl)-
4CP7BU47LD
Benzeneacetic acid, m-fluoro-
NS00042312
m-Fluorophenylacetic acid
AC-509/25002041
CS-W004799
MFCD00004331
3-Fluorophenylacetic acid
F0216
m-Fluorophenyl acetic acid

MDL Number

MFCD00004331

Customs Code

29163900

FAQ

What is (3-Fluorophenyl)acetic acid (CAS: 331-25-9)?

(3-Fluorophenyl)acetic acid is an organic compound with the molecular formula C9H9FO2. It is a carboxylic acid derivative containing a fluoro-substituted phenyl group. This compound is characterized by its acidic nature and reactive functional groups, which make it useful in various applications.

What are the main uses of (3-Fluorophenyl)acetic acid (CAS: 331-25-9)?

(3-Fluorophenyl)acetic acid is primarily used in the synthesis of pharmaceuticals and agrochemicals. Its unique chemical structure allows for the development of compounds with specific biological activities. It is also used in research as a starting material for the preparation of other organic compounds.

Is (3-Fluorophenyl)acetic acid (CAS: 331-25-9) safe?

(3-Fluorophenyl)acetic acid can be handled safely with proper precautions. It is corrosive and may cause skin irritation. Users should wear appropriate personal protective equipment, such as gloves and goggles, and ensure adequate ventilation during handling. Spills should be handled with care, and the compound should be stored away from heat sources and direct sunlight.

How should (3-Fluorophenyl)acetic acid (CAS: 331-25-9) be stored?

(3-Fluorophenyl)acetic acid should be stored in a cool, dry place, away from heat and sources of ignition. It should be protected from direct sunlight and stored in a tightly sealed container to prevent loss of the volatile components. Optimal storage conditions include a temperature range of 15-25°C and a relative humidity below 50% to maintain stability and purity of the compound. Regular checks should be made to ensure the integrity of the storage container and the product quality.