4-(Benzoylamino)butanoic acid

Basic Information

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CAS Number

35340-63-7

Molecular Formula

C11H13NO3

Molecular Weight

207.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Boiling Point

484.3°C at 760 mmHg

Density

1.191

Flash Point

246.7°C

Refractive Index

1.549

SMILES

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C1=CC=C(C=C1)C(=O)NCCCC(=O)O

InChI

InChI=1S/C11H13NO3/c13-10(14)7-4-8-12-11(15)9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2,(H,12,15)(H,13,14)

InChIKey

BOZHPKGNNJPZKV-UHFFFAOYSA-N

LogP

1.2812000000000001

Topological Polar Surface Area

66.4 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

222

Synonyms & References

English

4-(Benzoylamino)butanoic acid
3-benzoylaminobutanoic acid
4-[(phenylcarbonyl)amino]butanoic acid
4-Benzamidobutyric acid
4-benzoylaminobutanoic acid
4-Benzoylaminobutyric acid
4-Benzoylamino-butyric acid
BRN 1877942
BUTYRIC ACID, 4-BENZAMIDO-
DF 470
N-benzoyl-4-amino-butyric acid
N-Benzoyl-4-aminobutyric acid
Butanoic acid, 4-(benzoylamino)-
DB-253079
CS-0149233
EN300-18566
SR-01000313294
gamma-Benzoylaminobutyric acid
BOZHPKGNNJPZKV-UHFFFAOYSA-N
4-(Benzoylamino)butyric acid
SR-01000313294-1
4-(phenylformamido)butanoic acid
CHEMBL122303
ALBB-012909
n-benzoyl gamma-aminobutyric acid
4-benzamidobutanoic acid
4-benzamidobutanoicacid
N-benzoyl-gamma-aminobutyric acid
DTXSID00188837
Z85888857
SCHEMBL2033165

MDL Number

MFCD00459545

FAQ

What are the physical and chemical properties of 4-(Benzoylamino)butanoic acid (CAS: 35340-63-7)?

4-(Benzoylamino)butanoic acid (CAS: 35340-63-7) is a white crystalline solid with a molecular weight of approximately 242.21 g/mol. It has a melting point of 141-142°C and is sparingly soluble in water but more soluble in organic solvents. This compound is reactive, particularly towards nucleophilic substitution and acid-base reactions.

How is 4-(Benzoylamino)butanoic acid (CAS: 35340-63-7) typically synthesized?

4-(Benzoylamino)butanoic acid can be synthesized by reacting benzoyl chloride with butylamine followed by acetylation. Commonly, this involves the acylation of butyric acid with benzoyl chloride in the presence of a catalyst like pyridine. The reaction is typically performed at room temperature, and the product is isolated by recrystallization from ethanol.

What industries use 4-(Benzoylamino)butanoic acid (CAS: 35340-63-7)?

4-(Benzoylamino)butanoic acid is used in various industries. It finds applications in pharmaceuticals, where it can be a precursor in the synthesis of certain drugs. It is also used in the production of polymers, sensors, and as a reagent in analytical chemistry and organic synthesis.

What precautions should be taken when handling 4-(Benzoylamino)butanoic acid (CAS: 35340-63-7)?

When handling 4-(Benzoylamino)butanoic acid (CAS: 35340-63-7), proper personal protective equipment (PPE) such as gloves, goggles, and lab coat should be worn. This compound should be stored in a cool, dry place away from heat and direct sunlight. Handling should be done in a well-ventilated area or fume hood. In case of spill, use appropriate cleanup procedures and consult the Safety Data Sheet (SDS) for detailed instructions.