1-Boc-4-Bromoindole

Name: 1-Boc-4-Bromoindole
Brand: ChemScene
Availability: InStock
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CAS No. 676448-17-2
Cat. No. CS-W021304
Purity≥98%
MDL No.MFCD04117874

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

An item is classified as a dangerous good if our website displays Hazardous Material (HazMat) information for it.

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Structure of 676448-17-2

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Description

1-Boc-4-Bromoindole features a protected indole scaffold with a bromine substituent at the 4-position, enabling selective functionalization in synthetic sequences. The Boc group ensures stability during handling and reaction setup, while the halogen serves as a key handle for cross-coupling transformations. This compound integrates seamlessly into complex molecular architectures requiring controlled reactivity and orthogonal protection.

Application

1-Boc-4-Bromoindole serves as a versatile building block for the synthesis of substituted indoles and heterocyclic scaffolds. The Boc group provides stable protection of the indole nitrogen, enabling selective functionalization at C4 via palladium-catalyzed cross-coupling reactions. Its bench-stable nature and compatibility with standard reaction conditions facilitate efficient incorporation into complex molecules, making it ideal for medicinal chemistry and process development workflows.

General Information

CAS No. 676448-17-2
Cat. No. CS-W021304
Purity ≥98%
MDL No. MFCD04117874
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₃H₁₄BrNO₂
Molecular Weight 296.16
Synonym(s) tert-butyl 4-bromo-1H-indole-1-carboxylate
SMILES C(C)(C)(C)OC(=O)[N]2C1=CC=CC(=C1C=C2)Br

Computational Chemistry Data

TPSA 31.23
LogP 4.187
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Key Words

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1-Boc-4-Bromoindole

CAS No. 676448-17-2

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