113337-37-4

Basic information

• Product Name: Ethanone, 2-chloro-1-(2-nitrophenyl)- (9CI)
• Synonyms: Ethanone, 2-chloro-1-(2-nitrophenyl)- (9CI)
• CAS NO: 113337-37-4
• Molecular Formula: C₈H₆ClNO₃
• Molecular Weight: 199.59114
• Product Categories: ACETYLHALIDE
• Mol File: 113337-37-4.mol
• Article Data: 4

Chemical Properties

• Melting Point: 66-67 °C
• Boiling Point: 333°C at 760 mmHg
• Flash Point: 155.2°C
• Appearance: /
• Density: 1.384g/cm³
• Vapor Pressure: 0.00014mmHg at 25°C
• Refractive Index: 1.575
• CAS DataBase Reference: Ethanone, 2-chloro-1-(2-nitrophenyl)- (9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: Ethanone, 2-chloro-1-(2-nitrophenyl)- (9CI)(113337-37-4)
• EPA Substance Registry System: Ethanone, 2-chloro-1-(2-nitrophenyl)- (9CI)(113337-37-4)

Safety Data

• Hazardous Substances Data: 113337-37-4(Hazardous Substances Data)

Usage

InChI:InChI=1/C8H6ClNO3/c9-5-8(11)6-3-1-2-4-7(6)10(12)13/h1-4H,5H2

Upstream product

• 186581-53-3 diazomethane 
• 60-29-7 diethyl ether 
• 610-14-0 2-nitrobenzyl chloride 
• 577-59-3 2-acetylnitrobenzene 
• 532-27-4 1-chloroacetophenone 
• 7782-50-5 chlorine 
• 64-19-7 acetic acid 
• 860567-48-2 2-chloro-1-(2-nitro-phenyl)-ethanol 
• 4203-26-3 (2-nitrobenzoyl)diazomethane 
• 7647-01-0 hydrogenchloride 
• 579-71-5 2-nitrostyrene 

Downstream Products

• 482-89-3 1H,1H'-2,2'-Biindolylidene-3,3'-dione 
• 855938-19-1 3-(2-hydroxyamino-phenyl)-3-oxo-propionitrile 
• 64605-23-8 2'-amino-2-chloroacetophenone 
• 4203-26-3 (2-nitrobenzoyl)diazomethane 
• 119730-42-6 2-(2-nitrobenzoylmethylthio)-5-methylpyrimidin-4(1H)-one 
• 119730-18-6 6-methyl-2-((2-(2-nitrophenyl)-2-oxoethyl)thio)-pyrimidin-4(3H)-one 

Relevant articles and documents

Whole-cell yeast-mediated preparation of (R)-2-chloro-1-(3-nitrophenyl) ethanol as a synthetic precursor for (R)-phenylephrine

The incubated whole-cell biocatalyst of Pichia minuta JCM 3622 reduced 2-chloro-1-(3-nitrophenyl)ethanone to provide (R)-2-chloro-1-(3-nitrophenyl) ethanol with 99.2% ee in 87% isolated yield in the presence of Amberlite XAD-7 as a reservoir for the hydrophobic, crystalline and toxic substrate. The product was transformed to (R)-1-(3-hydroxyphenyl)-2-methylaminoethanol (phenylephrine, 1a), a selective α1-adrenergic receptor agonist, in 98.0% ee over five steps.

Ozone-mediated Nitration of Aromatic Ketones and Related Compounds with Nitrogen Dioxide

Alkyl aryl ketones react smoothly with nitrogen dioxide at low temperatures in the presence of ozone to give ortho- and meta-nitro derivatives as the principal products, the former usually being predominant (ortho:meta = 1.1-3.8:1.0).No attack was observed on the alkyl side chains.