2-(4-Aminophenyl)butanoic acid

Basic Information

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CAS Number

29644-97-1

Molecular Formula

C10H13NO2

Molecular Weight

179.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

142-143 ºC

SMILES

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CCC(C1=CC=C(C=C1)N)C(=O)O

InChI

InChI=1S/C10H13NO2/c1-2-9(10(12)13)7-3-5-8(11)6-4-7/h3-6,9H,2,11H2,1H3,(H,12,13)

InChIKey

WAPLXGPARWRGJO-UHFFFAOYSA-N

LogP

1.8470000000000002

Topological Polar Surface Area

63.32 Å²

Hydrogen Bond Donor/Acceptor

3 / 3

Complexity

174

Synonyms & References

English

Benzeneacetic acid,4-amino-a-ethyl-
NSC27530
SY294186
-(p-Aminophenyl)butyric acid
NSC-27530
2-(p-Aminophenyl)butyric acid
2-(4-aminophenyl)butanoic acid
2-(4'-Aminophenyl)butyric acid
NSC 27530
dl-alpha-(p-Aminophenyl)butyric acid
AKOS004117910
SCHEMBL261617
CS-0152617
A928941
alpha-(p-Aminophenyl)butyric acid
Benzeneacetic acid, 4-amino-alpha-ethyl-
MFCD00598059
BUTYRIC ACID, 2-(p-AMINOPHENYL)-
WAPLXGPARWRGJO-UHFFFAOYSA-N
DS-16584
FT-0651263
p-aminophenylbutyric acid
AKOS016843100
DTXSID201020312
29644-97-1
C74519
1-alpha-(p-Aminophenyl)butyric acid
2-(4-Aminophenyl)butanoic acid
Α, Α'-[1,6-HEXANEDIYLBIS(IMINOCARBONYL)]BIS[(Ω-ISONONYL PHENOXY)]POLY(OXY-1,2-ETHANEDIYL)
(+-)-2-(4-amino-phenyl)-butyric acid
?-(p-Aminophenyl)butyric acid

MDL Number

MFCD00598059

Customs Code

2922499990

FAQ

What are the physical and chemical properties of 2-(4-Aminophenyl)butanoic acid (CAS: 29644-97-1)?

2-(4-Aminophenyl)butanoic acid is a white crystalline solid with a molecular weight of 221.23 g/mol. It is slightly soluble in water and ethanol. The compound exhibits basic properties due to its amine functionality and is reactive towards acidic conditions. It shows good solubility in organic solvents like methanol and acetone. This compound is stable under normal conditions but should be stored in a dry, cool place away from direct sunlight.

How is 2-(4-Aminophenyl)butanoic acid (CAS: 29644-97-1) typically synthesized?

2-(4-Aminophenyl)butanoic acid is commonly synthesized via the condensation of 4-aminophenol with butanoic acid in the presence of a catalyst such as p-toluenesulfonic acid. The reaction is typically carried out in an organic solvent like methanol or ethanol. The yield of the product is around 70-80%, and the purity can be increased through recrystallization from hot ethanol.

What industries use 2-(4-Aminophenyl)butanoic acid (CAS: 29644-97-1)?

2-(4-Aminophenyl)butanoic acid is utilized in various industries. In pharmaceuticals, it serves as a precursor for the synthesis of bioactive compounds. It is also used in the production of polymers, where its amine functionality allows for the formation of specific chemical bonds. Additionally, it has applications in sensors and semiconductors due to its reactive properties and ability to form stable complexes.

What precautions should be taken when handling 2-(4-Aminophenyl)butanoic acid (CAS: 29644-97-1)?

When handling 2-(4-Aminophenyl)butanoic acid, it is important to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. The compound should be stored in a well-ventilated area away from direct sunlight. It should be handled in a fume hood to minimize exposure to fumes. In case of a spill, the area should be flushed with water and the contaminated material disposed of according to local regulations. Always refer to the Safety Data Sheet (SDS) for detailed safety information.