Methyl 2-methyl-1H-indole-5-carboxylate

Name: Methyl 2-methyl-1H-indole-5-carboxylate
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CAS No. 57663-18-0
Cat. No. CS-0091528
Purity≥96%
MDL No.None

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Methyl 2-methyl-1H-indole-5-carboxylate|CS-0091528

Structure of 57663-18-0

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Description

Methyl 2-methyl-1H-indole-5-carboxylate features a sterically hindered indole core with a strategically positioned methyl group at the 2-position, enhancing stability and modulating electronic properties. The ester functionality at the 5-position enables direct incorporation into synthetic sequences without protection, facilitating efficient derivatization in medicinal chemistry and materials synthesis under standard conditions.

Application

Methyl 2-methyl-1H-indole-5-carboxylate serves as a versatile building block in medicinal chemistry and heterocyclic synthesis. The indole core provides a rigid, aromatic scaffold amenable to late-stage functionalization, while the methyl ester group enables selective derivatization via hydrolysis or reduction. Its stability under standard reaction conditions and compatibility with common coupling protocols facilitate efficient access to complex molecular architectures.

General Information

CAS No. 57663-18-0
Cat. No. CS-0091528
Purity ≥96%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₁H₁₁NO₂
Molecular Weight 189.21
Synonym(s) Methyl 2-Methyl-3H-indole-5-carboxylate
SMILES O=C(C1=CC2=C(NC(C)=C2)C=C1)OC

Computational Chemistry Data

TPSA 42.09
LogP 2.26292
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-P330-P362-P405-P501

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Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Indole compounds

Key Words

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Methyl 2-methyl-1H-indole-5-carboxylate

CAS No. 57663-18-0

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