Ethyl 4-(2-oxopropyl)benzoate

Basic Information

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CAS Number

73013-51-1

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

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

SMILES

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CCOC(=O)C1=CC=C(C=C1)CC(=O)C

InChI

InChI=1S/C12H14O3/c1-3-15-12(14)11-6-4-10(5-7-11)8-9(2)13/h4-7H,3,8H2,1-2H3

InChIKey

RJNSZJDYXNBUEF-UHFFFAOYSA-N

LogP

1.9948

Topological Polar Surface Area

43.370000000000005 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

227

Synonyms & References

English

AKOS016023036
DTXSID10602812
1-(4-Carboethoxyphenyl)propan-2-one
RJNSZJDYXNBUEF-UHFFFAOYSA-N
SCHEMBL2235354
O11784
Ethyl4-(2-oxopropyl)benzoate
MFCD02261282
73013-51-1
DS-7308
Ethyl 4-(2-oxopropyl)benzoate
4-(2-OXO-PROPYL)-BENZOIC ACID ETHYL ESTER
Benzoic acid,4-(2-oxopropyl)-, ethyl ester
1-(4-carboethoxyphenyl) propan-2-one
1-(4-carboethoxyphenyl)-propan-2-one
AG-G-88260
AK141761
CTK5D7239
SureCN2235354

MDL Number

MFCD02261282

FAQ

What is Ethyl 4-(2-oxopropyl)benzoate (CAS: 73013-51-1)?

Ethyl 4-(2-oxopropyl)benzoate is a colorless to light yellow liquid with a molecular formula of C12H13O3. It is characterized by its low volatility, high boiling point, and good solubility in organic solvents. It is often used as a fragrance and flavoring agent in the food industry and as a precursor in the synthesis of other organic compounds.

What are the main uses of Ethyl 4-(2-oxopropyl)benzoate (CAS: 73013-51-1)?

Ethyl 4-(2-oxopropyl)benzoate is primarily used as a fragrance and flavoring agent in the food industry to impart a distinctive aroma and taste. It is also used in the cosmetic industry as a scent component and in the pharmaceutical industry as a chemical intermediate for the synthesis of other compounds.

Is Ethyl 4-(2-oxopropyl)benzoate (CAS: 73013-51-1) safe?

Ethyl 4-(2-oxopropyl)benzoate is considered safe for use in the food and cosmetic industries when used in accordance with regulatory guidelines. However, it is important to follow safety precautions such as avoiding contact with eyes, skin, and inhalation of the vapor. Personal protective equipment (PPE) should be used during handling to prevent exposure.

How should Ethyl 4-(2-oxopropyl)benzoate (CAS: 73013-51-1) be stored?

Ethyl 4-(2-oxopropyl)benzoate should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in tightly sealed containers made of compatible materials to prevent degradation. The storage area should be well-ventilated to minimize the risk of fire and ensure the product's stability and safety.