850349-72-3

Basic information

• Product Name: 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
• Synonyms: 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER;5-BROMO-3-IODOINDOLE, N-BOC PROTECTED;1-BOC-5-BROMO-3-IODO-INDOLE;tert-butyl 5-bromo-3-iodo-1H-indole-1-carboxylate;1H-Indole-1-carboxylic acid, 5-broMo-3-iodo-, 1,1-diMethylethyl ester;5-Bromo-3-iodo-1H-indole, N-BOC protected 98%;tert-Butyl 5-bromo-3-iodo-1H-indole-1-carboxylate, 5-Bromo-1-(tert-butoxycarbonyl)-3-iodo-1H-indole;5-Bromo-3-iodo-1H-indole,N-BOCprotected97%
• CAS NO: 850349-72-3
• Molecular Formula: C13H13BrINO2
• Molecular Weight: 422.06
• Product Categories: Indole
• Mol File: 850349-72-3.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 433.976 °C at 760 mmHg
• Flash Point: 216.261 °C
• Appearance: /
• Density: 1.816 g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.64
• Storage Temp.: 2-8°C(protect from light)
• CAS DataBase Reference: 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(850349-72-3)
• EPA Substance Registry System: 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER(850349-72-3)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 850349-72-3(Hazardous Substances Data)

Usage

Description

5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is a chemical compound with the formula C13H13BrINO2, derived from the heterocyclic indole structure commonly found in plant-based natural products. The tert-butyl ester group on the carboxylic acid increases the compound's stability, making it a versatile building block for organic synthesis. Its unique structure and reactivity contribute to its value in the fields of organic chemistry and drug discovery.

Uses

Used in Organic Synthesis:
5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is used as a building block for the synthesis of various biologically active molecules, enhancing the development of new pharmaceuticals and agrochemicals. Its stability and reactivity make it a valuable component in the creation of complex organic compounds.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is used as a key intermediate in the synthesis of drugs, contributing to the development of novel therapeutic agents. Its unique properties allow for the design of molecules with specific biological activities, potentially leading to new treatments for various diseases.
Used in Agrochemical Industry:
5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is also utilized in the agrochemical industry as a precursor for the development of new pesticides and other crop protection agents. Its role in creating effective and environmentally friendly agrochemicals is crucial for advancing sustainable agricultural practices.
Used in Drug Discovery:
In the field of drug discovery, 5-BROMO-3-IODOINDOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER is employed as a valuable tool for the exploration of new chemical entities with potential therapeutic effects. Its unique structure allows researchers to probe the interactions between molecules and biological targets, facilitating the identification of promising drug candidates.

InChI:InChI=1/C13H13BrINO2/c1-13(2,3)18-12(17)16-7-10(15)9-6-8(14)4-5-11(9)16/h4-7H,1-3H3