Methyl 4-amino-3-methoxybenzoate

Basic Information

View in Editor

CAS Number

41608-64-4

Molecular Formula

C9H11NO3

Molecular Weight

181.19 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

Physical State

White to Yellow Solid

Melting Point

125-127°C

Boiling Point

332°C at 760 mmHg

Flash Point

175.4℃

SMILES

View in Editor

COC1=C(C=CC(=C1)C(=O)OC)N

InChI

InChI=1S/C9H11NO3/c1-12-8-5-6(9(11)13-2)3-4-7(8)10/h3-5H,10H2,1-2H3

InChIKey

DJLFOMMCQBAMAA-UHFFFAOYSA-N

LogP

1.064

Topological Polar Surface Area

61.55 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

184

Safety Information

View Safety Information

GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-Amino-3-methoxybenzoic acid methyl ester
NS00031016
SY018276
41608-64-4
methyl 4-amino-3-methoxybenzoate, AldrichCPR
AKOS005072826
UNII-F37JMF7S7F
Methyl 4-amino-3-methoxybenzoate
Benzoic acid, 3-methoxy-4-amino-, methyl ester
MFCD00017203
METHYL 4-AMINO-3-METHOXY BENZOATE
AM20061009
SCHEMBL155160
Methyl 4-amino-3-methoxybenzoate, 98%
FT-0600681
Methyl4-amino-3-methoxybenzoate
AC-28498
J-522298
EN300-122300
F37JMF7S7F
CS-B0715
EINECS 255-456-5
BCP04117
methyl 4-amino-3-methoxybenzenecarboxylate
methyl 4-amino-3-methoxy-benzoate
methyl 3-methoxy-4-aminobenzoate
A6857
FA-0713
Benzoic acid, 4-amino-3-methoxy-, methyl ester
4-Amino-3-methoxy-benzoic acid methyl ester
4-Amino-3-methoxy benzoic acid methyl ester

MDL Number

MFCD00017203

Customs Code

2922509090

FAQ

What are the physical and chemical properties of Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4)?

Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4) is a white to off-white crystalline solid with a molecular weight of approximately 219.22 g/mol. It has a solubility of about 3.5 g/L in water and is practically insoluble in ethanol. This compound is moderately reactive and susceptible to hydrolysis under basic conditions. It has a melting point around 79-81°C and is stable under normal laboratory conditions, but care should be taken to avoid prolonged exposure to moisture.

How is Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4) typically synthesized?

Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4) can be synthesized via the esterification of 4-amino-3-methoxybenzoic acid with methanol in the presence of a suitable catalyst such as sulfuric acid or p-toluenesulfonic acid. The reaction is typically carried out at a temperature of around 80°C, with an isolated yield of approximately 80-85%. The reaction is selective and proceeds with good stereoselectivity.

What industries use Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4)?

Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4) is used in the pharmaceutical industry as an intermediate in the synthesis of certain drugs. It is also utilized in the polymer industry as a stabilizer and in the production of dyes. Additionally, it can be used in the production of sensors and as a component in some semiconductor materials due to its specific chemical properties.

What precautions should be taken when handling Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4)?

When handling Methyl 4-amino-3-methoxybenzoate (CAS: 41608-64-4), appropriate personal protective equipment (PPE) should be worn, including gloves, safety goggles, and a lab coat. This compound should be stored in a well-ventilated area and away from moisture. Fume hoods should be used during its manipulation to minimize inhalation risk. In the event of a spill, it should be cleaned up using appropriate absorbent materials and the area should be thoroughly washed with water. Consult the Material Safety Data Sheet (MSDS) for detailed spill and emergency response procedures.