Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate

Basic Information

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CAS Number

7588-36-5

Molecular Formula

C13H15NO3

Molecular Weight

233.27 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 Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

SMILES

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CC1=C(C2=C(N1)C=CC(=C2)OC)CC(=O)OC

InChI

InChI=1S/C13H15NO3/c1-8-10(7-13(15)17-3)11-6-9(16-2)4-5-12(11)14-8/h4-6,14H,7H2,1-3H3

InChIKey

JYUNCKSXPPDNRM-UHFFFAOYSA-N

LogP

2.2004200000000003

Topological Polar Surface Area

51.32000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

282

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H317 May cause an allergic skin reaction
Sensitization, Skin

Synonyms & References

English

Methyl 5-methoxy-2-methyl-1H-indole-3-acetate
Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate
Indole-3-acetic acid, 5-methoxy-2-methyl-, methyl ester
FT-0671919
MFCD00218549
NS00037736
methyl 2-(5-methoxy-2-methyl-1H-indol-3-yl)acetate
Methyl 5-Methoxy-2-methylindole-3-acetate
CS-0041770
EINECS 231-497-4
F11958
5-methoxy-2-methyl-1h-indole-3-acetic acid methyl ester
SCHEMBL6825151
methyl 5-methoxy-2-methyl-3-indolylacetate
DS-8672
Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate #
AKOS015851515
Methyl 5-Methoxy-2-methylindole-3-acetate; 1H-Indole-3-acetic acid, 5-methoxy-2-methyl-, methyl ester; Indole-3-acetic acid, 5-methoxy-2-methyl-, methyl ester (7CI,8CI); 5-Methoxy-2-methylindole-3-acetic acid methyl ester; Methyl 5-methoxy-2-methylindole-3-acetate
methyl-5-methoxy-2-methyl-3-indolylacetate
methyl2-(5-methoxy-2-methyl-1H-indol-3-yl)acetate
DTXSID40226782
1H-Indole-3-acetic acid, 5-methoxy-2-methyl-, methyl ester
methyl [5-methoxy-2-methyl-indol-3-yl]-acetate
7588-36-5
Oprea1_567770
Methyl ester of 2-Methyl-5-methoxyindole-3-acetic acid
methyl [2-methyl-5-(methyloxy)-1h-indol-3-yl]acetate
1H-Indole-3-aceticacid, 5-methoxy-2-methyl-, methyl ester
methyl 5-methoxy-2-methyl-1H-indole-3-acetate
Methyl 5-Methoxy-2-m
(5-methoxy-2-methyl-1H-indol-3-yl)acetic acid methyl ester

MDL Number

MFCD00218549

FAQ

What are the physical and chemical properties of Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate (CAS: 7588-36-5)?

Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate is a colorless to light yellow liquid. It has a molecular weight of approximately 236.34 g/mol. This compound is moderately soluble in water but highly soluble in organic solvents such as ethanol and acetone. It shows limited reactivity under normal conditions but may undergo hydrolysis when exposed to strong acids or bases. Its physical state is stable under standard laboratory conditions.

How is Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate (CAS: 7588-36-5) typically synthesized?

Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate is synthesized via a multi-step process involving reaction of methyl indole-3-yl acetate with methanol in the presence of a strong acid catalyst like sulfuric acid. The process yields a product with a high degree of purity and selectivity, with a yield typically around 80-90%. This method ensures a controlled and efficient synthesis of the compound.

What industries use Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate (CAS: 7588-36-5)?

Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate is primarily used in the pharmaceutical industry for the synthesis of certain drug intermediates. It also finds applications in the polymer industry as a precursor for the production of specific polymers. Additionally, this compound is used in the flavor and fragrance industry due to its distinctive aroma profile. Its use in sensors and semiconductors is less common but not entirely absent.

What precautions should be taken when handling Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate (CAS: 7588-36-5)?

When handling Methyl (5-methoxy-2-methyl-1H-indol-3-yl)acetate, it is important to wear appropriate personal protective equipment, including gloves, safety goggles, and a lab coat. This compound should be stored in a cool, dry place away from direct sunlight and heat sources. Fume hoods should be used during handling to minimize inhalation risks. In case of a spill, immediately clean it up using absorbent material and dispose of it according to local regulations. Always refer to the safety data sheet (SDS) for detailed handling instructions and emergency procedures.