90534-62-6

Basic information

• Product Name: 1,3-Cyclohexanedione, 2-(2-oxopropyl)-
• CAS NO: 90534-62-6
• Molecular Formula: C9H12O3
• Molecular Weight: 168.192
• Mol File: 90534-62-6.mol
• Article Data: 14

Chemical Properties

• CAS DataBase Reference: 1,3-Cyclohexanedione, 2-(2-oxopropyl)-(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3-Cyclohexanedione, 2-(2-oxopropyl)-(90534-62-6)
• EPA Substance Registry System: 1,3-Cyclohexanedione, 2-(2-oxopropyl)-(90534-62-6)

Safety Data

• Hazardous Substances Data: 90534-62-6(Hazardous Substances Data)

Upstream product

• 504-02-9 1,3-cylohexanedione 
• 598-31-2 1-bromoacetone 
• 78-98-8 2-oxopropanal 
• 78-95-5 chloroacetone 
• 105104-40-3 Okahara's reagent 

Downstream Products

• 1354789-58-4 C₄₈H₃₈N₄ 
• 1260673-30-0 ethyl [3-(4-chlorophenylsulfanyl)-4-(hydroxyimino)-2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl]acetate 
• 1260673-38-8 [3-(4-chlorophenylsulfanyl)-4-(hydroxyimino)-2-methyl-4,5,6,7-tetrahydro-1H-indol-1-yl]acetic acid 
• 1260673-36-6 [3-(4-chlorophenylsulfanyl)-2-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl]acetic acid 

Relevant articles and documents

A novel and green synthesis of indolone-N-amino acid derivatives via the Passerini three-component reactions in water

A green Passerini three-component reaction of 2-(4-oxo-4,5,6,7-tetrahydro-1H-indol-1-yl)acetic acid with alkyl or aryl isocyanides and aldehydes was reported under aqueous conditions at 35 °C for 1 h, and 21 indolone-N-amino acid derivatives were prepared

Urea decomposition: Efficient synthesis of pyrroles using the deep eutectic solvent choline chloride/urea

A simple and efficient method is reported for the synthesis of pyrroles via condensation of a series of tricarbonyl compounds with ammonia, which was generated in situ from decomposition of the deep eutectic solvent choline chloride/urea.

Structure-activity relationships (SAR) and structure-kinetic relationships (SKR) of sulphone-based CRTh2 antagonists

Monocyclic and bicyclic ring systems were investigated as the "core" section of a series of diphenylsulphone-containing acetic acid CRTh2 receptor antagonists. A range of potencies were observed and single-digit nanomolar potencies were obtained in both the monocyclic and bicyclic cores. Residence times for the monocyclic compounds were very short. Some of the bicyclic cores displayed better residence times. A methyl group in the northern part of the core, between the head and tail was a necessary requirement for the beginnings of long residence times. Variations of the tail substitution maximised potencies and residence times.