111216-73-0

Basic information

• Product Name: 2-BROMO-3-METHYL-N-PHENYLBUTANAMIDE
• Synonyms: α-bromo-isovaleric acid anilide;Butanamide, 2-bromo-3-methyl-N-phenyl-
• CAS NO: 111216-73-0
• Molecular Formula: C₁₁H₁₄BrNO
• Molecular Weight: 256.14
• Mol File: 111216-73-0.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 368.1°Cat760mmHg
• Flash Point: 176.4°C
• Appearance: /
• Density: 1.377g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.582
• CAS DataBase Reference: 2-BROMO-3-METHYL-N-PHENYLBUTANAMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-BROMO-3-METHYL-N-PHENYLBUTANAMIDE(111216-73-0)
• EPA Substance Registry System: 2-BROMO-3-METHYL-N-PHENYLBUTANAMIDE(111216-73-0)

Safety Data

• Hazardous Substances Data: 111216-73-0(Hazardous Substances Data)

Usage

InChI:InChI=1/C11H14BrNO/c1-8(2)10(12)11(14)13-9-6-4-3-5-7-9/h3-8,10H,1-2H3,(H,13,14)

Upstream product

• 503-74-2 3-methylbutyric acid 
• 10323-40-7 2-bromoisovaleric acid 
• 62-53-3 aniline 
• 26464-05-1 2-bromo-3-methyl-butyryl bromide 

Downstream Products

• 54639-27-9 N-phenyl-2-hydroxy-3-methyl-butanamide 
• 874507-15-0 5-(α-bromo-isobutyl)-1-phenyl-1H-tetrazole 

Relevant articles and documents

Investigation of the synthetic and mechanistic aspects of the highly stereoselective transformation of α-thioamides to α-thio-β- chloroacrylamides

Treatment of a series of α-thioamides with N-chlorosuccinimide results in efficient transformation to the analogous α-thio-β- chloroacrylamides. The mechanistic pathway has been established through isolation and characterisation of intermediate compounds. The scope of the transformation has been explored - aryl and alkylthio substituents, primary, secondary and tertiary amides can be employed. In most instances, the chloroacrylamides are formed exclusively as the Z-stereoisomer; however, with tertiary propanamides or with amides derived from butanoic or pentanoic acid a mixture of E- and Z-stereoisomers is formed. The Royal Society of Chemistry.