Methyl 6-chloro-1H-indole-5-carboxylate

Name: Methyl 6-chloro-1H-indole-5-carboxylate
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CAS No. 162100-83-6
Cat. No. CS-0018495
Purity≥95%
MDL No.MFCD11976069

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl 6-chloro-1H-indole-5-carboxylate|CS-0018495

Structure of 162100-83-6

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Description

Methyl 6-chloro-1H-indole-5-carboxylate features a chlorinated indole core with a methyl ester at the C5 position, enabling direct integration into heterocyclic synthesis. The electron-deficient aromatic system enhances reactivity in transition-metal-catalyzed couplings, while the ester group provides a handle for selective derivatization. This bench-stable intermediate supports efficient access to bioactive indole scaffolds in medicinal chemistry and materials science applications.

Application

Methyl 6-chloro-1H-indole-5-carboxylate serves as a versatile building block for the synthesis of substituted indoles and heterocyclic scaffolds. The methyl ester group enables straightforward derivatization, while the 6-chloro substituent facilitates palladium-catalyzed cross-coupling reactions. Its stability under standard reaction conditions and compatibility with diverse functional groups make it well-suited for medicinal chemistry and process development workflows.

General Information

CAS No. 162100-83-6
Cat. No. CS-0018495
Purity ≥95%
MDL No. MFCD11976069
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₈ClNO₂
Molecular Weight 209.63
Synonym(s) Methyl 6-chloroindole-5-carboxylate
SMILES O=C(C1=CC2=C(NC=C2)C=C1Cl)OC

Computational Chemistry Data

TPSA 42.09
LogP 2.6079
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 1

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

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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Key Words

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Methyl 6-chloro-1H-indole-5-carboxylate

CAS No. 162100-83-6

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