Description

1H-Indole-1-Carboxylic Acid, 5-(3-Methoxy-3-Oxo-1-Propenyl)-, 1,1-Dimethylethyl Ester is a high-purity, advanced pharmaceutical intermediate characterized by its complex indole-based molecular structure. This compound matters as a critical building block in the synthesis of novel active pharmaceutical ingredients (APIs), enabling the development of targeted therapies. It is primarily needed by research institutions and pharmaceutical manufacturers engaged in the development of complex organic molecules, particularly for applications in medicinal chemistry and drug discovery.

Application

• Pharmaceutical Intermediate: A key precursor in the multi-step synthesis of complex indole-based drug candidates and active pharmaceutical ingredients (APIs).
• Medicinal Chemistry Research: Serves as a versatile scaffold for structure-activity relationship (SAR) studies and the development of new therapeutic agents.
• Organic Synthesis Building Block: Used in advanced organic reactions, including cross-coupling and esterification/transesterification processes, to construct more complex molecular architectures.
• Agrochemical Research: Potential intermediate in the development of novel crop protection agents and specialty agrochemicals.
• Material Science: Investigated for the synthesis of specialized organic compounds with potential applications in advanced materials.

Basic Information

Item	Details
Product Name	1H-Indole-1-Carboxylic Acid, 5-(3-Methoxy-3-Oxo-1-Propenyl)-, 1,1-Dimethylethyl Ester
CAS No.	561307-71-9
Molecular Formula	C18H21NO4
Molecular Weight	315.36 g/mol
Synonyms	tert-Butyl 5-(3-methoxy-3-oxoprop-1-en-1-yl)-1H-indole-1-carboxylate; 1-(tert-Butoxycarbonyl)-5-(3-methoxy-3-oxo-1-propenyl)indole; 5-(3-Methoxy-3-oxo-1-propenyl)-1H-indole-1-carboxylic acid 1,1-dimethylethyl ester; Boc-5-(3-Methoxy-3-oxopropenyl)indole; 1-Boc-5-(3-Methoxyacryloyl)indole; 561307-71-9; tert-Butyl 5-(2-carbomethoxyvinyl)indole-1-carboxylate
EINECS	Contact for details

Quality Control

Our 1H-Indole-1-Carboxylic Acid, 5-(3-Methoxy-3-Oxo-1-Propenyl)-, 1,1-Dimethylethyl Ester is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC and NMR, to ensure high chemical purity and structural integrity. Certificates of Analysis (COA) detailing purity, identity, and impurity profiles are available upon request to support your quality assurance and regulatory documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). This compound is light-sensitive (store away from light) and may be hygroscopic (moisture-sensitive); therefore, containers should be kept sealed under an inert atmosphere if specified. Keep away from strong acids/bases and oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.