Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate

Basic Information

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CAS Number

15574-49-9

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

Melting Point

210.0 to 214.0 deg-C

Boiling Point

399.8℃ at 760 mmHg

Density

1.2

Flash Point

195.6℃

Refractive Index

1.571

SMILES

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CCOC(=O)C1=C(N(C2=C1C=C(C=C2)O)C)C

InChI

InChI=1S/C13H15NO3/c1-4-17-13(16)12-8(2)14(3)11-6-5-9(15)7-10(11)12/h5-7,15H,4H2,1-3H3

InChIKey

YTBNTDMBGXAOCG-UHFFFAOYSA-N

LogP

2.36902

Topological Polar Surface Area

51.46 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

294

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Mecarbinatum
HMS3655F17
RS-0114
Oprea1_078760
AE-641/02016046
CHEMBL1881106
Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate
Ethyl 1,2-dimethyl-5-hydroxyindole-3-carboxylate
Mecarbine
5-Hydroxy-1,2-dimethyl-1H-indole-3-carboxylic acid ethyl ester
CAS-15574-49-9
5-Hydroxy-1,2-dimethylindol-3-carbonsaeureethylester
Z927X3UJ2W
AB01566886_01
Z57178280
Oprea1_434116
F1920-0014
YTBNTDMBGXAOCG-UHFFFAOYSA-N
ETHYL 1,2-DIMETHYL-5-HYDROXYINDOLE-2-CARBOXYLATE
s2074
Ethyl 5-hydroxy-1,2-dimethylindole-3-carboxylate
1,2-Dimethyl-5-hydroxyindole-3-Carboxylate Ethyl
CCG-104192
BB 0216474
Mecarbinate
FT-0637248
BA 2676
BCP26910
A15262
BRD-K28405228-001-01-8
Dimecarbin

MDL Number

MFCD00451373

Customs Code

2933990090

FAQ

What is Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9)?

Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate is an organic compound with the CAS number 15574-49-9. It is a derivative of indole with a unique structure that includes an ethyl group, a hydroxyl group, and methyl groups. This compound is characterized by its aromatic ring system and carboxylic acid functionality, which contribute to its potential applications in various fields.

What are the main uses of Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9)?

Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9) is primarily used in pharmaceuticals for its potential as a bioactive molecule. It may also find applications in research, particularly in studies related to indole derivatives, due to its structural features. Its use in industry and food is limited due to its specialized nature and potential toxicity.

Is Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9) safe?

Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9) requires caution when handling due to its potential toxicity. It is advisable to follow safety guidelines, including the use of appropriate personal protective equipment such as gloves and goggles. Storage away from heat sources and in a well-ventilated area is recommended to minimize the risk of adverse reactions.

How should Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9) be stored?

Ethyl 5-hydroxy-1,2-dimethyl-1H-indole-3-carboxylate (CAS: 15574-49-9) should be stored at room temperature in a tightly sealed container to prevent degradation. It is important to keep it away from heat sources, direct sunlight, and moisture to maintain its stability. Adequate ventilation should be ensured to prevent the accumulation of potentially flammable vapors.