5414-21-1

Basic information

• Product Name: 5-BROMOVALERONITRILE
• Synonyms: 5-Bromovaleronitrile,95%;5-BroMovaleronitrile, 95% 1GR;5-BROMOVALERONITRILE FOR SYNTHESIS;1-Cyano-4-bromobutane;4-Cyanobutyl bromide;5-BroMovaleronitile;5-Bromovaleronitrile 98%;Valeronitrile, 5-bromo-
• CAS NO: 5414-21-1
• Molecular Formula: C₅H₈BrN
• Molecular Weight: 162.03
• EINECS: 226-505-8
• Product Categories: Cyanides/Nitriles;Nitrogen Compounds;NULL;C1 to C5
• Mol File: 5414-21-1.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 110-111 °C (12 mmHg)
• Flash Point: >230 °F
• Appearance: /
• Density: 1.388 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.037mmHg at 25°C
• Refractive Index: n20/D 1.478(lit.)
• Storage Temp.: Store below +30°C.
• Water Solubility: Slightly soluble in water (4.1 g/L at 25°C).
• BRN: 1742080
• CAS DataBase Reference: 5-BROMOVALERONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 5-BROMOVALERONITRILE(5414-21-1)
• EPA Substance Registry System: 5-BROMOVALERONITRILE(5414-21-1)

Safety Data

• Hazard Codes: Xn,Xi
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36
• RIDADR: UN 3276 6.1/PG 3
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 5414-21-1(Hazardous Substances Data)

Usage

Chemical Properties

CLEAR COLOURLESS TO LIGHT YELLOW LIQUID

Uses

Different sources of media describe the Uses of 5414-21-1 differently. You can refer to the following data:
1. 5-Bromovaleronitrile is used to produce 5-Bromo-pentanoic acid.
2. 5-Bromovaleronitrile can be used as a reactant to prepare: A key intermediate benzyl(methyl)amino)pentanenitrile, which is used in the synthesis of N-methylcadaverine.1-cyanobutyl-3-alkylbenzimidazolium bromide salt by reacting with various N-alkylbenzimidazoles.Tridecanenitrile by Ni-catalyzed cross-coupling reaction with dioctylzinc in the presence of tetraene and MgBr2.

InChI:InChI=1/C5H8BrN/c6-4-2-1-3-5-7/h1-4H2

Upstream product

• 110-52-1 1,4-dibromo-butane 
• 151-50-8 potassium cyanide 
• 143-33-9 sodium cyanide 
• 123-91-1 1,4-dioxane 
• 109-64-8 1,3-dibromo-propane 
• 75-05-8 acetonitrile 
• 60-29-7 diethyl ether 
• 61862-52-0 5-hydroxy pentanal oxime 

Downstream Products

• 5454-83-1 5-bromovaleric acid methyl ester 
• 14660-52-7 ethyl 5-bromovalerate 
• 59121-25-4 5-(methylsulfanyl)pentanenitrile 
• 15102-28-0 5-(1,3-dioxoisoindolin-2-yl)pentanenitrile 
• 15295-69-9 hept-6-ynenitrile 
• 57050-07-4 2-phenyl-3,4,5,6-tetrahydropyridine 
• 2067-33-6 5-bromopentanoic acid 
• 52605-46-6 5-[4-(2-propylmercapto-phenyl)-piperazino]-pentylamine 
• 3209-45-8 5-(dimethylamino)-pentanenitrile 
• 37094-78-3 benzyl 4-cyanobutyl sulfide 
• 7743-27-3 (4-cyanobutyl)triphenylphosphonium bromide 
• 29304-29-8 2-Phenyl-6-cyanohexaldehyd 
• 101438-79-3 5-[[2-(3,4-dimethoxyphenyl)ethyl](methyl)amino]pentanenitrile 
• 2243-27-8 nonanonitrile 

Relevant articles and documents

Synthetic Studies on d-Biotin, Part 6:1 An Expeditious and Enantiocontrolled Approach to the Total Synthesis of d-Biotin via a Polymer-Supported Chiral Oxazaborolidine-Catalyzed Reduction of meso-Cyclic Imide Strategy

An efficient and highly enantioselective synthesis of d-biotin from the known cis-1,3-dibenzyl-2-imidazolidone-4,5-dicarboxylic acid (5) was accomplished in 48% overall yield. The key reactions in the sequence involve the catalytic enantioselective reduction of meso-cyclic imide 6 using polymer-supported chiral oxazoborolidine, derived from (S)-α,α -diphenylprolinol and polymer-bound sulfonyl chloride, and the installation of the C5 side chain at C4 in the thiolactone 9 via a Ni/C-catalyzed Fukuyama coupling reaction.

Synthesis of pyridine-containing macrocycles by cobalt-mediated trimerization of triply-bonded species

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ALKYLATION OF ANIONS ON SOLID INORGANIC SUPPORTS: SYNTHESIS OF NITRILES, ESTERS, PHENOLIC ETHERS AND MONO-C-SUBSTITUTED ACETOACETIC ESTERS.

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