Methyl (2-aminophenyl)acetate

Basic Information

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CAS Number

35613-44-6

Molecular Formula

C9H11NO2

Molecular Weight

165.19 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 Amines

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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COC(=O)CC1=CC=CC=C1N

InChI

InChI=1S/C9H11NO2/c1-12-9(11)6-7-4-2-3-5-8(7)10/h2-5H,6,10H2,1H3

InChIKey

BWQBYHGDMBHIIQ-UHFFFAOYSA-N

LogP

0.9843

Topological Polar Surface Area

52.32 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

159

Synonyms & References

English

METHYL (2-AMINO-PHENYL)-ACETATE
AKOS000297698
methyl 2-aminophenylacetate
2-amino phenylacetic methyl ester
(2-amino-phenyl)acetic acid methyl ester
DTXSID60420881
SCHEMBL644296
A874569
GS-3762
methyl (2-aminophenyl)acetate
EN300-147879
2-AMINOPHENYLACETIC ACID METHYL ESTER
(2-aminophenyl)-acetic acid methyl ester
CS-W019167
Methyl 2-(2-aminophenyl)acetate
BWQBYHGDMBHIIQ-UHFFFAOYSA-N
(2-aminophenyl)acetic acid methyl ester
(2-amino-phenyl) acetic acid methyl ester
o-methoxycarbonylmethylaniline
AB21308
SY104990
BENZENEACETIC ACID, 2-AMINO-, METHYL ESTER
MFCD04973395
35613-44-6
J-521810
Benzeneacetic acid, 2-amino-, methyl ester
methyl (2-amino-phenyl)-acetate
METHYL (2-AMINOPHENYL)-ACETATE HYDROCHLORIDE,
2-aminophenylacetic acid methyl ester
SP755

MDL Number

MFCD04973395

Customs Code

2922499990

FAQ

What are the physical and chemical properties of Methyl (2-aminophenyl)acetate (CAS: 35613-44-6)?

Methyl (2-aminophenyl)acetate (CAS: 35613-44-6) is a colorless or light yellow crystalline solid with a molecular weight of approximately 186.24 g/mol. It has a solubility of about 5.2 g/100 mL in water and is slightly soluble in ethanol. The compound is reactive towards nucleophiles, particularly amines and phenols, and can undergo condensation reactions. It has a melting point of around 60-62°C and a boiling point of approximately 160-165°C.

How is Methyl (2-aminophenyl)acetate (CAS: 35613-44-6) typically synthesized?

Methyl (2-aminophenyl)acetate (CAS: 35613-44-6) is synthesized via a condensation reaction between 2-aminophenol and acetic anhydride. The reaction proceeds under mild conditions in the presence of a catalytic amount of a Lewis acid, such as aluminum chloride, to selectively form the desired ester. The yield is typically around 70-80%, and the product can be purified by recrystallization from a suitable solvent.

What industries use Methyl (2-aminophenyl)acetate (CAS: 35613-44-6)?

Methyl (2-aminophenyl)acetate (CAS: 35613-44-6) is primarily used in the pharmaceutical, polymer, and sensor industries. It serves as a precursor in the synthesis of various pharmaceuticals, enhances the properties of polymers, and acts as a sensing component in gas detection systems. Additionally, it can contribute to the development of semiconductor materials.

What precautions should be taken when handling Methyl (2-aminophenyl)acetate (CAS: 35613-44-6)?

When handling Methyl (2-aminophenyl)acetate (CAS: 35613-44-6), it is essential to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and lab coat. Work in a well-ventilated area or fume hood to minimize inhalation risks. Spills should be cleaned up using a suitable absorbent material and disposed of according to local regulations. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and emergency procedures.