2-Methyl-2-propanyl 4-bromo-1H-indole-1-carboxylate

Basic Information

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CAS Number

676448-17-2

Molecular Formula

C13H14BrNO2

Molecular Weight

296.16 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

SMILES

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CC(C)(C)OC(=O)N1C=CC2=C1C=CC=C2Br

InChI

InChI=1S/C13H14BrNO2/c1-13(2,3)17-12(16)15-8-7-9-10(14)5-4-6-11(9)15/h4-8H,1-3H3

InChIKey

ZGBNKNOAADXGOH-UHFFFAOYSA-N

LogP

4.187000000000003

Topological Polar Surface Area

31.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

300

Safety Information

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Hazard Statement

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

CS-W021304
tert-butyl 4-bromoindole-1-carboxylate
4-bromo-indole-1-carboxylic acid-tert-butyl ester
4-BROMOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
SCHEMBL1284244
SY064493
FT-0600105
4-Bromo-indole-1-carboxylic Acid tert-Butyl Ester
DTXSID00654209
A9056
EN300-6766852
ZGBNKNOAADXGOH-UHFFFAOYSA-N
PS-7154
AM20050413
1H-Indole-1-carboxylic acid, 4-bromo-, 1,1-dimethylethyl ester
N-Boc-4-bromoindole
676448-17-2
tert-butyl 4-bromo-1H-indole-1-carboxylate
MB03354
1-Boc-4-Bromoindole
4-BROMOINDOLE, N-BOC PROTECTED
MFCD04117874
AKOS015841204
tert-butyl-4-bromo-1H-indole-1-carboxylate
4-Bromoindole-1-carboxylic acid tert-butyl ester
PubChem9120
4-Bromoindole,N-BOC protected
MFC

MDL Number

MFCD04117874

Customs Code

2933990090

FAQ

What is 2-Methyl-2-propanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2)?

2-Methyl-2-propanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) is a chemical compound with a molecular structure consisting of an indole ring, a methyl group, and a bromo group. It is used in the synthesis of various pharmaceuticals and organic compounds. The compound is colorless to white crystalline solid with a distinctive odor.

What are the main uses of 2-Methyl-2-propanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2)?

2-Methyl-2-propanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) is primarily used in the synthesis of pharmaceuticals, specifically for the production of new drugs. It serves as a key intermediate in organic synthesis, helping to create complex molecules with desired biological activities.

Is 2-Methyl-2-proanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) safe?

2-Methyl-2-proanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) can be handled safely with appropriate protective measures. It is important to work in a well-ventilated area and to use appropriate personal protective equipment, such as gloves and goggles. Direct contact with skin or ingestion should be avoided.

How should 2-Methyl-2-proanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) be stored?

2-Methyl-2-proanyl 4-bromo-1H-indole-1-carboxylate (CAS: 676448-17-2) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in tightly sealed containers to prevent moisture absorption. It is recommended to store it between 15-25°C (59-77°F) and avoid exposure to temperatures above 30°C (86°F).