6-Bromo-4-chloro-1H-indole

Name: 6-Bromo-4-chloro-1H-indole
Brand: ChemScene
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CAS No. 885519-01-7
Cat. No. CS-W019333
Purity≥96%
MDL No.MFCD07781351

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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+

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Structure of 885519-01-7

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General Information

CAS No. 885519-01-7
Cat. No. CS-W019333
Purity ≥96%
MDL No. MFCD07781351
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₅BrClN
Molecular Weight 230.49
Synonym(s) None
SMILES ClC1=CC(Br)=CC2=C1C=CN2

Description

6-Bromo-4-chloro-1H-indole is a halogenated indole scaffold featuring bromine at the 6-position and chlorine at the 4-position, enabling selective functionalization in synthetic transformations. This electron-deficient heterocycle integrates readily into complex molecular architectures, particularly in medicinal chemistry and materials science applications.

Application

6-Bromo-4-chloro-1H-indole serves as a versatile building block for the synthesis of biologically active heterocycles and pharmaceutical intermediates. Its well-defined regiochemistry enables selective functionalization at C-2 or C-3 positions via palladium-catalyzed cross-coupling reactions. The molecule exhibits excellent bench stability, facilitates straightforward purification, and demonstrates broad compatibility with common protecting group strategies in medicinal chemistry workflows.

Safety Information

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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

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Computational Chemistry Data

TPSA 15.79
LogP 3.5838
H_Acceptors 0
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Key Words

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6-Bromo-4-chloro-1H-indole

CAS No. 885519-01-7

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