Methyl (3,4-dihydroxyphenyl)acetate

Basic Information

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CAS Number

25379-88-8

Molecular Formula

C9H10O4

Molecular Weight

182.18 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

Basic Physical Properties

Melting Point

53.0 to 57.0 deg-C

Boiling Point

433.1±45.0 °C at 760 mmHg

Density

1.3±0.1 g/cm3

Flash Point

215.8±28.7 °C

Solubility

Chloroform (Slightly), Methanol (Slightly)

Refractive Index

1.575

Vapor Pressure

0.0±1.0 mmHg at 25°C

SMILES

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COC(=O)CC1=CC(=C(C=C1)O)O

InChI

InChI=1S/C9H10O4/c1-13-9(12)5-6-2-3-7(10)8(11)4-6/h2-4,10-11H,5H2,1H3

InChIKey

UGFILLIGHGZLHE-UHFFFAOYSA-N

LogP

0.8132999999999999

Topological Polar Surface Area

66.76 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

181

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

Homoprotocatechuic Acid Methyl Ester
J-015971
BDBM50062147
Pyrocatechol-4-acetic Acid Methyl Ester
FT-0638516
(3,4-dihydroxyphenyl)-acetic acid methyl ester
3 pound not4-Dihydroxyphenylacetic Acid Methyl Ester
3,4-Dihydroxyphenylacetic Acid Methyl Ester
MFCD00583539
A817833
Benzeneacetic acid, 3,4-dihydroxy-, methyl ester
Methyl 3,4-dihydroxyphenylacetate
PD169377
methyl homoprotocatechuate
ERGOLINE-8-CARBOXYLICACIDMETHYLESTER
Methyl2-(3,4-dihydroxyphenyl)acetate
methyl 2-(3, 4-dihydroxyphenyl)acetate
DTXSID70451666
CS-W017123
EN300-732967
SY053925
Catechol-4-acetic Acid Methyl Ester
AS-44408
AKOS015900183
D2734
25379-88-8
methyl (3,4-dihydroxyphenyl)acetate
Methyl 2-(3,4-dihydroxyphenyl)acetate
UGFILLIGHGZLHE-UHFFFAOYSA-N
HY-W016407
SCHEMBL3668882

MDL Number

MFCD00583539

Customs Code

2918290000

FAQ

What are the physical and chemical properties of Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8)?

Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8) is a solid compound with a crystalline form. It has a molecular weight of approximately 228.25 g/mol. The compound is slightly soluble in water and has limited solubility in common organic solvents. Chemically, it is reactive towards bases and can undergo esterification reactions. It is a phenolic compound and displays acidity due to the hydroxyl groups.

How is Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8) typically synthesized?

Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8) can be synthesized via the esterification of methyl acetate with 3,4-dihydroxybenzoic acid. The reaction is typically catalyzed by an acid or base catalyst, and the product can be isolated by recrystallization. The yield of the reaction is generally between 75-90%, with good selectivity towards the desired product.

What industries use Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8)?

Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8) is used in the pharmaceutical industry for the synthesis of certain drugs. It also finds applications in the polymer industry as a monomer or additive. Additionally, it is used in the development of sensors and as a precursor in the preparation of functional materials for semiconductors.

What precautions should be taken when handling Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8)?

When handling Methyl (3,4-dihydroxyphenyl)acetate (CAS: 25379-88-8), it is crucial to wear appropriate personal protective equipment (PPE), including gloves, safety goggles, and a lab coat. The compound should be handled in a well-ventilated area, preferably in a fume hood, to avoid inhalation of vapors. In case of a spill, it should be cleaned up using appropriate absorbent materials, and the area should be flushed with water. The safety data sheet (SDS) should be consulted for detailed emergency response procedures and storage recommendations.