1-Phenylethyl propionate

Basic Information

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CAS Number

120-45-6

Molecular Formula

C11H14O2

Molecular Weight

178.23 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

-60 ºC

Boiling Point

206 ºC

Water Solubility

0.04 g/L (20 ºC)

Flash Point

106 ºC

Refractive Index

1.489-1.491

SMILES

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CCC(=O)OC(C)c1ccccc1

InChI

InChI=1S/C11H14O2/c1-3-11(12)13-9(2)10-7-5-4-6-8-10/h4-9H,3H2,1-2H3

InChIKey

WCIQNYOXLZQQMU-UHFFFAOYSA-N

LogP

2.700800000000001

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

160

Synonyms & References

English

1-phenylethyl propionate
Styrallyl propionate
1-phenylethanol propionate
1-phenylethyl
1-phenylethyl propanoate
Acid ester Styrax
MBA-Propionate
Methylbenzylpropionat
rac-1-phenyl-1-ethyl-propionate
STYROLYLPROPIONAT
styrolylpropionate
alpha-Methylbenzylalcohol propionate
Phenylmethylcarbinolpropionate
Propanoic acid 2-phenylethyl ester
alpha-methylbenzylpropanoate
1-Phenylethylpropionate

MDL Number

MFCD00009305

Customs Code

2915509000

FAQ

What regulatory guidelines apply to 1-Phenylethyl propionate (CAS: 120-45-6)?

1-Phenylethyl propionate (CAS: 120-45-6) is regulated under various guidelines including the European Union REACH regulations, and the U.S. EPA and FDA. It is important to follow specific handling, storage, and disposal requirements to ensure safety and compliance.

Are there alternatives to 1-Phenylethyl propionate (CAS: 120-45-6) in synthesis?

Several alternatives to 1-Phenylethyl propionate (CAS: 120-45-6) exist, including other esters with similar properties. Common alternatives include benzyl propionate and other phenylethyl esters, which may be used depending on the specific application and desired properties.

What is the market or research trend for 1-Phenylethyl propionate (CAS: 120-45-6)?

The market for 1-Phenylethyl propionate (CAS: 120-45-6) is growing due to its use in fragrances and flavorings. Research trends focus on its potential applications in natural products and organic synthesis, as well as environmental impact studies and safer alternatives.

How should waste containing 1-Phenylethyl propionate (CAS: 120-45-6) be handled?

Waste containing 1-Phenylethyl propionate (CAS: 120-45-6) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method, but ensure it is conducted in compliance with environmental regulations to minimize environmental impact.