Ethyl (3S)-3-hydroxy-3-phenylpropanoate

Basic Information

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CAS Number

33401-74-0

Molecular Formula

C11H14O3

Molecular Weight

194.23 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

Refractive Index

n20/D 1.510

SMILES

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

InChI

InChI=1S/C11H14O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7,10,12H,2,8H2,1H3/t10-/m0/s1

InChIKey

DVIBDQWVFHDBOP-JTQLQIEISA-N

LogP

1.6731999999999998

Topological Polar Surface Area

46.53 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

173

Synonyms & References

English

MFCD00216721
E84354
Ethyl 3-phenylhydracrylate, (S)-
(S)-Ethyl 3-Hydroxy-3-phenylpropanoate
Z1255372825
ethyl (S)-3-hydroxy-3-phenylpropionate
CS-0204588
3S4J5C6Q4Z
SCHEMBL7056947
BS-27961
(S)-Ethyl3-Hydroxy-3-phenylpropanoate
(S)-(-)-Ethyl-3-hydroxy 3-phenylpropionate
3-hydroxy-3-phenyl-propionic acid ethyl ester
DVIBDQWVFHDBOP-JTQLQIEISA-N
ETHYL (S)-3-HYDROXY-3-PHENYLPROPANOATE
(3S)-3-Hydroxy-3-phenylpropionic acid ethyl ester
(S)-ethyl 3-phenylhydracrylate
Q27257964
ethyl (3S)-3-hydroxy-3-phenylpropanoate
Hydracrylic acid, 3-phenyl-, ethyl ester, (S)-
(S)-(-)-3-Hydroxy-3-Phenylpropionic Acid Ethyl Ester
AC-26773
BENZENEPROPANOIC ACID, .BETA.-HYDROXY-, ETHYL ESTER, (.BETA.S)-
Benzenepropanoic acid, beta-hydroxy-, ethyl ester, (betaS)-
Ethyl 3-phenylhydracrylate, (-)-
A5954
AKOS015901796
Ethyl (S)-3-phenylhydracrylate
33401-74-0
UNII-3S4J5C6Q4Z
EN300-121105

MDL Number

MFCD00216721

FAQ

What are the physical and chemical properties of Ethyl (3S)-3-hydroxy-3-phenylpropanoate (CAS: 33401-74-0)?

Ethyl (3S)-3-hydroxy-3-phenylpropanoate is a colorless to slightly yellow liquid with a molecular weight of approximately 180.24 g/mol. It has a solubility of up to 12 g/L in water and is soluble in common organic solvents such as ethanol and acetone. This compound is moderately reactive, particularly towards nucleophilic attack, and is known for its reactivity in esterification reactions.

How is Ethyl (3S)-3-hydroxy-3-phenylpropanoate (CAS: 33401-74-0) typically synthesized?

Ethyl (3S)-3-hydroxy-3-phenylpropanoate is commonly synthesized via the esterification of (3S)-3-hydroxy-3-phenylpropanoic acid with ethanol. This process often involves the use of a strong acid catalyst, such as concentrated sulfuric acid, at elevated temperatures. The yield can be improved by using a phase transfer catalyst and optimizing reaction conditions for selectivity and yield.

What industries use Ethyl (3S)-3-hydroxy-3-phenylpropanoate (CAS: 33401-74-0)?

Ethyl (3S)-3-hydroxy-3-phenylpropanoate is primarily used in the pharmaceutical industry as an intermediate in the synthesis of certain drugs. It also finds applications in the polymer industry as a monomer for producing functionalized polymers. Additionally, it is used in the development of new sensor technologies and as a precursor in semiconductor manufacturing processes.

What precautions should be taken when handling Ethyl (3S)-3-hydroxy-3-phenylpropanoate (CAS: 33401-74-0)?

When handling Ethyl (3S)-3-hydroxy-3-phenylpropanoate, it is important to wear appropriate personal protective equipment (PPE), including safety goggles, gloves, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up with care, using appropriate absorbents, and the area should be thoroughly rinsed with water. Always refer to the SDS (Safety Data Sheet) for detailed information on handling and storage precautions.