Methyl 6-chloro-1H-indole-3-carboxylate

Name: Methyl 6-chloro-1H-indole-3-carboxylate
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CAS No. 921194-97-0
Cat. No. CS-0036177
Purity≥98%
MDL No.MFCD09836004

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Methyl 6-chloro-1H-indole-3-carboxylate|CS-0036177

Structure of 921194-97-0

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Description

Methyl 6-chloro-1H-indole-3-carboxylate features a chlorinated indole scaffold with a carboxylate ester at the 3-position, offering enhanced solubility and reactivity for synthetic modifications. This bench-stable derivative serves as a key intermediate in medicinal chemistry campaigns targeting kinase inhibitors and CNS-active compounds.

Application

Methyl 6-chloro-1H-indole-3-carboxylate serves as a versatile building block in medicinal chemistry and synthetic organic chemistry. The molecule features a chlorinated indole core with a methyl ester at the C3 position, enabling facile functionalization via standard cross-coupling reactions and nucleophilic substitution. Its bench-stable nature and compatibility with diverse reaction conditions make it ideal for constructing complex heterocyclic scaffolds and API intermediates.

General Information

CAS No. 921194-97-0
Cat. No. CS-0036177
Purity ≥98%
MDL No. MFCD09836004
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₈ClNO₂
Molecular Weight None
Synonym(s) 1H-Indole-3-carboxylic acid, 6-chloro-, methyl ester
SMILES COC(=O)C1=CNC2=C1C=CC(=C2)Cl

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-H317-H319
Precautionary Statements : P280-P305+P351+P338

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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-3-carboxylate

CAS No. 921194-97-0

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