113423-48-6

Basic information

• Product Name: 3,3-DIBROMO-5-CHLORO-1,3-DIHYDROINDOL-2-ONE
• Synonyms: 3,3-DIBROMO-5-CHLORO-1,3-DIHYDROINDOL-2-ONE
• CAS NO: 113423-48-6
• Molecular Formula: C₈H₄Br₂ClNO
• Molecular Weight: 325.38
• Mol File: 113423-48-6.mol

Chemical Properties

• Boiling Point: 382 °C at 760 mmHg
• Flash Point: 184.9 °C
• Appearance: /
• Density: 2.166 g/cm³
• Vapor Pressure: 4.86E-06mmHg at 25°C
• Refractive Index: 1.694
• PKA: 9.20±0.40(Predicted)
• CAS DataBase Reference: 3,3-DIBROMO-5-CHLORO-1,3-DIHYDROINDOL-2-ONE(CAS DataBase Reference)
• NIST Chemistry Reference: 3,3-DIBROMO-5-CHLORO-1,3-DIHYDROINDOL-2-ONE(113423-48-6)
• EPA Substance Registry System: 3,3-DIBROMO-5-CHLORO-1,3-DIHYDROINDOL-2-ONE(113423-48-6)

Safety Data

• Hazardous Substances Data: 113423-48-6(Hazardous Substances Data)

Usage

Uses

Used in Organic Chemistry Research:
3,3-Dibromo-5-chloro-1,3-dihydroindol-2-one is used as a research compound for studying its chemical properties and reactivity. Its unique structure allows chemists to explore various reactions and transformations, contributing to the advancement of organic chemistry.
Used in Chemical Synthesis:
As a building block or precursor, 3,3-dibromo-5-chloro-1,3-dihydroindol-2-one is used in the synthesis of other chemical compounds. Its presence of bromine and chlorine atoms on the indole ring provides opportunities for further functionalization and modification, enabling the creation of novel compounds with potential applications in various fields.
Used in Medicinal Chemistry and Pharmaceutical Research:
3,3-Dibromo-5-chloro-1,3-dihydroindol-2-one is employed as a key intermediate in the development of new drugs and therapeutic agents. Its unique structure and reactivity make it a promising candidate for the design and synthesis of bioactive molecules with potential applications in the treatment of various diseases and medical conditions.
Used in Drug Discovery and Development:
In the pharmaceutical industry, 3,3-dibromo-5-chloro-1,3-dihydroindol-2-one is used as a starting material for drug discovery and development. Its versatile chemical properties allow for the design of new drug candidates with improved efficacy, selectivity, and safety profiles, ultimately leading to the development of innovative treatments for various diseases.
Overall, 3,3-dibromo-5-chloro-1,3-dihydroindol-2-one is a significant chemical compound in the fields of organic chemistry, chemical synthesis, medicinal chemistry, and pharmaceutical research, with a wide range of applications and potential for further exploration and development.

InChI:InChI=1/C8H4Br2ClNO/c9-8(10)5-3-4(11)1-2-6(5)12-7(8)13/h1-3H,(H,12,13)

Upstream product

• 17422-32-1 5-chloro-1H-indole 
• 17630-75-0 5-chloro-indolin-2-one 

Downstream Products

• 17630-75-0 5-chloro-indolin-2-one 
• 17630-76-1 5-chloroindole 2,3-dione 

Relevant articles and documents

A convenient synthesis of 3-methyleneoxindoles: Cytotoxic metabolites of indole-3-acetic acids

3-Methyleneoxindole is a cytotoxic metabolite of indole-3-acetic acid with potential for use in cancer therapy. This species and ring-substituted analogues are conveniently synthesised from the corresponding isatins via a Peterson olefination.

Synthetic method for indol-2(3H)-ones

A two-step process for the synthesis of certain indol-2(3H)-ones from indoles, and the 3,3-dibromoindol-2(3H)-ones which are intermediates in that process.

OXIDATION OF INDOLES WITH PYRIDINIUM BROMIDE PERBROMIDE. A SIMPLE AND EFFICIENT SYNTHESIS OF 7-AZAOXINDOLES

Indoles and azaindoles on treatment with pyridinium bromide perbromide (PBPB) in t-butanol give 3,3-dibromooxindoles which, upon further reduction, yield the corresponding oxindoles.