4-Pentanoylbenzoic acid

Basic Information

View in Editor

CAS Number

79784-62-6

Molecular Formula

C12H14O3

Molecular Weight

206.24 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

View in Editor

CCCCC(=O)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C12H14O3/c1-2-3-4-11(13)9-5-7-10(8-6-9)12(14)15/h5-8H,2-4H2,1H3,(H,14,15)

InChIKey

GWNGCRPYKPVEBL-UHFFFAOYSA-N

LogP

2.7577000000000007

Topological Polar Surface Area

54.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

227

Synonyms & References

English

A864804
4-Pentanoylbenzoicacid
4-pentanoyl-benzoic acid
4-Pentanoylbenzoic acid
GWNGCRPYKPVEBL-UHFFFAOYSA-N
79784-62-6
SCHEMBL5456494
4-pentanoylbenzoic acid
p-valerylbenzoic acid

MDL Number

MFCD24489986

FAQ

What regulatory guidelines apply to 4-Pentanoylbenzoic acid (CAS: 79784-62-6)?

4-Pentanoylbenzoic acid (CAS: 79784-62-6) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), which includes hazard communication elements such as signal words, pictograms, and hazard statements. In the European Union, it falls under the Registration, Evaluation, Authorization, and Restriction of Chemicals (REACH) regulation. For the United States, it is regulated by the Environmental Protection Agency (EPA) and the Food and Drug Administration (FDA) based on its intended use and application.

Are there alternatives to 4-Pentanoylbenzoic acid (CAS: 79784-62-6) in synthesis?

Several alternatives to 4-Pentanoylbenzoic acid (CAS: 79784-62-6) can be used in synthesis, including 4-Hydroxybenzoic acid and 4-Chlorobenzoic acid. These alternatives can serve as precursors or intermediates in similar reactions, depending on the specific requirements of the synthesis process.

What is the market or research trend for 4-Pentanoylbenzoic acid (CAS: 79784-62-6)?

The market for 4-Pentanoylbenzoic acid (CAS: 79784-62-6) is growing due to its applications in pharmaceuticals, cosmetics, and other industries. Research trends are focusing on its use in drug delivery systems and as a raw material for the production of other chemical compounds. Price trends suggest an increasing demand, but stability in supply remains a challenge.

How should waste containing 4-Pentanoylbenzoic acid (CAS: 79784-62-6) be handled?

Waste containing 4-Pentanoylbenzoic acid (CAS: 79784-62-6) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a suitable method for disposal, and it is important to follow environmental protection guidelines to minimize environmental impact. Proper labeling and documentation of waste are crucial to ensure compliance with regulatory requirements.