Ethyl 2-((4-cyanophenyl)amino)acetate

Basic Information

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CAS Number

218168-58-2

Molecular Formula

C11H12N2O2

Molecular Weight

204.23 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

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CCOC(=O)CNC1=CC=C(C=C1)C#N

InChI

InChI=1S/C11H15NO2/c1-3-14-11(13)8-12-10-6-4-9(2)5-7-10/h4-7,12H,3,8H2,1-2H3

InChIKey

RFCHXXFHULMCDW-UHFFFAOYSA-N

LogP

1.9700199999999999

Topological Polar Surface Area

38.33 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

249

Synonyms & References

English

Ethyl 2-((4-cyanophenyl)amino)acetate
ethyl 2-(4-cyanoanilino)acetate
Glycine, N-(4-cyanophenyl)-, ethyl ester
AK104720
ANW-71060
CTK8C4107
KB-252021
MolPort-004-406-388
DTXSID80632429
218168-58-2
A878922
ETHYL 2-[(4-CYANOPHENYL)AMINO]ACETATE
N-(4-Cyanophenyl)glycine ethyl ester
AKOS000259914
EN300-6510891
Ethyl (4-cyanophenyl)glycinate
Ethyl N-(4-cyanophenyl)glycinate
BCP12926
CS-0099758
SCHEMBL16166309
Glycine,N-(4-cyanophenyl)-,ethyl ester
Ethyl2-((4-cyanophenyl)amino)acetate
HY-W047769

MDL Number

MFCD11153542

FAQ

What are the physical and chemical properties of Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2)?

Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2) is a crystalline solid with a molecular weight of approximately 247.2 g/mol. It has a slight solubility in water and is more soluble in organic solvents like ethanol and acetone. This compound is moderately reactive, particularly in the presence of acidic or basic conditions. It can undergo hydrolysis and condensation reactions.

How is Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2) typically synthesized?

Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2) is typically synthesized by the reaction of 4-cyanophenylamine with ethyl acetoacetate using a mild base like sodium hydroxide as the catalyst. The reaction proceeds under reflux conditions, yielding a high yield of the target compound with good selectivity.

What industries use Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2)?

Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2) is used in the pharmaceutical industry for the synthesis of certain derivatives and intermediates. It is also utilized in the polymer industry for the development of functional polymers. Additionally, it has applications in the semiconductor industry for thin film production and in the sensor industry as a functional material.

What precautions should be taken when handling Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2)?

When handling Ethyl 2-((4-cyanophenyl)amino)acetate (CAS: 218168-58-2), it is essential to wear appropriate personal protective equipment (PPE), including gloves, goggles, and a lab coat. Storage should be in a cool, dry place away from direct sunlight. Fume hoods should be used during synthesis to minimize inhalation exposure. In case of a spill, immediately clean up with appropriate absorbent materials and consult the Safety Data Sheet (SDS) for further instructions.