5445-25-0

Basic information

• Product Name: NSC21985
• Synonyms: NSC21985;Benzeneacetic acid, .alpha.-broMo-4-chloro-, ethyl ester;ethyl 2-broMo-2-(4-chlorophenyl)acetate;Ethyl a-bromo-4-chlorophenylacetate
• CAS NO: 5445-25-0
• Molecular Formula: C₁₀H₁₀BrClO₂
• Molecular Weight: 277.5422
• Mol File: 5445-25-0.mol
• Article Data: 11

Chemical Properties

• Boiling Point: 304.8°C at 760 mmHg
• Flash Point: 138.1°C
• Appearance: /
• Density: 1.503g/cm³
• Vapor Pressure: 0.000854mmHg at 25°C
• Refractive Index: 1.557
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• CAS DataBase Reference: NSC21985(CAS DataBase Reference)
• NIST Chemistry Reference: NSC21985(5445-25-0)
• EPA Substance Registry System: NSC21985(5445-25-0)

Safety Data

• Hazardous Substances Data: 5445-25-0(Hazardous Substances Data)

Usage

General Description

NSC21985, also known as N-9,1-dioxa-4,7-dithiaspiro[4.4]nonan-2-yl-3-phenylpropanamide, is a chemical compound often used in scientific research for its pharmacological activities. The exact properties and effects of NSC21985 largely depend on its usage context and it might require certain precautions while handling. The compound falls into the category of organic compounds and specifically, organoheterocyclic compounds. There is limited public information about NSC21985, indicating that it's not commonly used in commercial products or applications. This could further suggest that its use is primarily confined to controlled scientific environments. Its other codes include ST50822032 and ZINC8656765. This chemical is provided by eMolecules, a provider of high-quality chemical building blocks.

InChI:InChI=1/C10H10BrClO2/c1-2-14-10(13)9(11)7-3-5-8(12)6-4-7/h3-6,9H,2H2,1H3

Upstream product

• 1878-66-6 4-chlorophenylacetic Acid 
• 14062-24-9 4-chloro-benzeneacetic acid, ethyl ester 
• 33512-03-7 3-(4-chlorophenyl)oxirane-2,2-dicarbonitrile 
• 64-17-5 ethanol 
• 13511-29-0 ethyl 2-(4-chlorophenyl)-2-hydroxyacetate 
• 66985-46-4 (+/-)-2-(4-chlorophenyl)-2-(trimethylsiloxy)-acetonitrile 
• 104-88-1 4-chlorobenzaldehyde 
• 1867-38-5 4-chlorobenzylidenemalonodinitrile 

Downstream Products

• 77143-78-3 (4-Chloro-phenyl)-(4-methoxycarbonylmethyl-phenoxy)-acetic acid ethyl ester 
• 77143-73-8 2-{4-[(4-Chloro-phenyl)-ethoxycarbonyl-methoxy]-phenyl}-propionic acid methyl ester 
• 17559-40-9 (1S,2R)-1-(4-Chloro-phenyl)-cyclopropane-1,2-dicarboxylic acid diethyl ester 
• 158507-14-3 (4-Chloro-phenyl)-(2-pyrrol-1-yl-phenylsulfanyl)-acetic acid ethyl ester 
• 199436-88-9 ethyl p-chlorophenyl(diethoxyphosphinoyl)acetate 
• 220965-65-1 ethyl α-(2-nitro-3-thienylthio)-4-chlorophenylacetate 
• 220965-67-3 2-(4-chlorophenyl)-3,4-dihydro-2H-thieno<3,2-b><1,4>thiazine 
• 220965-62-8 2-(4-chlorophenyl)-2H-thieno<3,2-b><1,4>thiazin-3(4H)-one 
• 199437-04-2 2-(4-Chloro-phenyl)-3-cyano-2-(diethoxy-phosphoryl)-propionic acid ethyl ester 
• 199436-91-4 N-[2-(4-Chloro-phenyl)-2-(diethoxy-phosphoryl)-ethyl]-phthalamic acid 
• 199436-89-0 2-(4-Chloro-phenyl)-2-(diethoxy-phosphoryl)-3-(1,3-dioxo-1,3-dihydro-isoindol-2-yl)-propionic acid ethyl ester 

Relevant articles and documents

MCL1 INHIBITORS

The present disclosure generally relates to compounds of Formula (I) and pharmaceutical compositions that may be used in methods of treating cancer.

Synthesis of α,α-disubstituted α-amino esters: Nucleophilic addition to iminium salts generated from amino ketene silyl acetals

Alkoxycarbonyl iminium species are prepared easily by the oxidation of tetrasubstituted amino ketene silyl acetals, and subsequent nucleophilic addition of Grignard reagents to the iminium salts gives α,α- disubstituted α-amino ester derivatives in moderate to good yields, in which aryl and ethynyl substituents are readily introduced.

Potential GABAB Receptor Antagonists. X* the Synthesis of Further Analogues of Baclofen, Phaclbfen and Saclofen

In an attempt to obtain new compounds with binding activity at the GABAB receptor site, we report the synthesis of 3-amino-2-arylpropanoic acids, and the sulfonic, phosphonic and hydroxamic acid analogues. In addition, we report the synthesis of the isomer of phaclofen, 3-amino-1-(4-chlorophenyl)-propylphosphonic acid, and the higher homologue of baclofen, 5-amino-2-(4-chlorophenyl)pentanoic acid.