Ethyl 5-bromo-1H-indole-2-carboxylate

Basic Information

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CAS Number

16732-70-0

Molecular Formula

C11H10BrNO2

Molecular Weight

268.11 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

164.0 to 168.0 deg-C

Boiling Point

394.7°Cat760mmHg

Density

1.554

Flash Point

192.5℃

Refractive Index

1.646

SMILES

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CCOC(=O)C1=CC2=C(N1)C=CC(=C2)Br

InChI

InChI=1S/C11H10BrNO2/c1-2-15-11(14)10-6-7-5-8(12)3-4-9(7)13-10/h3-6,13H,2H2,1H3

InChIKey

LWRLKENDQISGEU-UHFFFAOYSA-N

LogP

3.107100000000001

Topological Polar Surface Area

42.09 Å²

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

247

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

B-8720
DTXSID70293321
5-bromoindolecarboxylic acid ethyl ester
5-bromo-indole-2-carboxylic acid ethyl ester
EN300-1212474
AB01334319-02
ethyl 5-bromo-1H-indole-2-carboxylate
5-Bromoindole-2-carboxylic acid ethyl ester
FA-0732
HY-W002128
SY006381
ethyl-5-bromoindole-2-carboxylate
LWRLKENDQISGEU-UHFFFAOYSA-N
5-Bromo-1H-indole-2-carboxylic acid ethyl ester
NSC88620
1H-Indole-2-carboxylic acid, 5-bromo-, ethyl ester
A3712
2-(Ethoxycarbonyl)-5-bromo-indole
ethyl5-bromo-1H-indole-2-carboxylate
AC-3603
CL3433
AC-22704
CS-W002128
NCGC00341792-01
MFCD00022701
AKOS001476070
5-bromoindol-2-carboxylic acid ethyl ester
NSC-88620
AM20030121
5-Bromo-2-ethoxycarbonyl indole
FT-0601334

MDL Number

MFCD00022701

Customs Code

2933990090

FAQ

What is Ethyl 5-bromo-1H-indole-2-carboxylate (CAS: 16732-70-0)?

Ethyl 5-bromo-1H-indole-2-carboxylate is a chemical compound with the CAS number 16732-70-0. It is an organic compound characterized by a bromine substituent on the indole ring and a carboxylic acid group. This compound is used in medicinal chemistry and as a research reagent in organic synthesis.

What are the main uses of Ethyl 5-bromo-1H-indole-2-carboxylate (CAS: 16732-70-0)?

Ethyl 5-bromo-1H-indole-2-carboxylate is primarily used as a key intermediate in the synthesis of pharmaceuticals and natural product analogues. It serves as a building block for developing new drugs and conducting research in organic chemistry.

Is Ethyl 5-bromo-1H-indole-2-carboxylate (CAS: 16732-70-0) safe?

Ethyl 5-bromo-1H-indole-2-carboxylate is generally safe when handled with appropriate personal protective equipment. However, it should be used with care due to its potential for skin and eye irritation. Proper ventilation and adherence to safety guidelines are essential.

How should Ethyl 5-bromo-1H-indole-2-carboxylate (CAS: 16732-70-0) be stored?

Ethyl 5-bromo-1H-indole-2-carboxylate should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to keep it in a tightly sealed container to prevent degradation. Refrigeration is not necessary but can be beneficial for longer-term storage to maintain stability.