6280-87-1

Basic information

• Product Name: 5-Chlorovaleronitrile
• Synonyms: 4-CHLORO-N-BUTYL CYANIDE;Chlorovaleronitrile;5-Chlorovaneronitrile;5-Chlorovaleronitrile,97%;5-CHLOROVALERONITRILE 97%;5-CHLORO-N-VALERONITRILE 95+%;4-Chlorobutyl Cyanide;5-Chloropentanenitrile
• CAS NO: 6280-87-1
• Molecular Formula: C₅H₈ClN
• Molecular Weight: 117.58
• EINECS: 228-481-4
• Product Categories: API intermediates;Building Blocks;C1 to C5;Chemical Synthesis;Cyanides/Nitriles;Nitrogen Compounds;Organic Building Blocks
• Mol File: 6280-87-1.mol
• Article Data: 6

Chemical Properties

• Boiling Point: 92-93 °C (10 mmHg)
• Flash Point: 209 °F
• Appearance: Clear/Liquid
• Density: 1.045 g/mL at 25 °C(lit.)
• Vapor Pressure: 0.116mmHg at 25°C
• Refractive Index: n20/D 1.446(lit.)
• Storage Temp.: Store below +30°C.
• BRN: 1742079
• CAS DataBase Reference: 5-Chlorovaleronitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 5-Chlorovaleronitrile(6280-87-1)
• EPA Substance Registry System: 5-Chlorovaleronitrile(6280-87-1)

Safety Data

• Hazard Codes: T,Xi
• Statements: 23/24/25
• Safety Statements: 36/37/39-45
• RIDADR: UN 3276 6.1/PG 3
• WGK Germany: 3
• HazardClass: 6.1
• PackingGroup: III
• Hazardous Substances Data: 6280-87-1(Hazardous Substances Data)

Usage

Chemical Properties

clear liquid

InChI:InChI=1/C5H8ClN/c6-4-2-1-3-5-7/h1-4H2

Upstream product

• 110-59-8 pentanonitrile 
• 1192-28-5 Cyclopentanone oxime 
• 110-56-5 1,4-dichlorobutane 
• 6940-78-9 4-chlorobutyl bromide 
• 143-33-9 sodium cyanide 
• 109-70-6 1.3-chlorobromopropane 
• 75-05-8 acetonitrile 
• 74-85-1 ethene 
• 506-77-4 cyanogen chloride 
• 61862-52-0 5-hydroxy pentanal oxime 
• 2427-16-9 5-hydroxy-pentanenitrile 

Downstream Products

• 4734-49-0 5-piperidinovaleronitrile 
• 14273-86-0 methyl 5-chloropentanoate 
• 1462-94-8 2-butyl-1-azacyclohexene 
• 102173-70-6 2,2-diphenyl-heptanedinitrile 
• 872306-79-1 2-(2,3-dimethoxy-phenyl)-heptanedinitrile 
• 104296-36-8 5-(4-nitrophenoxy)pentanenitrile 
• 101438-80-6 5-(ethyl-veratryl-amino)-valeronitrile 
• 56528-76-8 6-cyclohexyl-2,3,4,5-tetrahydro-pyridine 
• 16728-56-6 5-phenoxy-pentanenitrile 
• 47096-71-9 1,4-bis(cyanobutoxy)benzene 
• 104295-63-8 5-(3-nitro-phenoxy)-valeronitrile 
• 104295-64-9 5-(2-nitro-phenoxy)-valeronitrile 
• 40232-85-7 5-(4-hydroxy-phenoxy)-valeronitrile 
• 542-28-9 3,4,5,6-tetrahydro-2H-pyran-2-one 

Relevant articles and documents

Catalytic Beckmann rearrangement of ketoximes in ionic liquids

Under mild conditions and without any additional organic solvents, Beckmann rearrangements of several ketoximes were performed in the catalytic media consisting of room temperature ionic liquid based on 1,3-dialkylimidazolium or alkylpyridinium salts and

MECHANISMS OF FREE-RADICAL REACTIONS. XXIV. QUANTITATIVE DESCRIPTION OF THE POLAR EFFECTS OF SUBSTITUENTS ON THE KINETICS OF THE FREE-RADICAL CHLORINATION OF ALIPHATIC COMPOUNDS BY N-CHLOROPIPERIDINE

The free-radical chlorination of 1-substituted alkanes with electron-withdrawing substituents by N-chloropiperidine in trifluoroacetic acid was studied by the method of competing reactions, and the relative rate constants were obtained for all positions of the substrates.The data on the position selectivity can be described satisfactorily by means of an electrostatic model of the polar effect of the substituent, calculated according to the Kirkwood-Westheimer equation.The obtained characteristics of the electrostatic effect can be successfully applied to calculation of the substrate selectivity and the intermolecular relative rate constants for all the positions, beginning with the third.The Taft equation is unsuitable for description of the effect of substituents on the reaction rate.

MECHANISMS OF FREE-RADICAL REACTIONS. XIV. SELECTIVITY OF FREE-RADICAL CHLORINATION OF VALERIC ACID DERIVATIVES WITH ARYLCHLOROIODONIUM CHLORIDES

The free-radical chlorination of C4H9Y compounds with arylchloroiodonium chlorides was investigated.The reaction of the secondary C-H bonds increases as they become further from the electronegative substituent.The reaction parameters were calculated from the ratio of the β- and γ-monochlorides by means of the Taft equation.The absolute value of ρ increases with the introduction of electronwithdrawing substituents into the arylchloroiodonium chloride molecule.