2114-42-3

Basic information

• Product Name: ALLYLCYCLOHEXANE
• Synonyms: prop-2-enyl-cyclohexane;3-CYCLOHEXYLPROPENE;3-CYCLOHEXYL-1-PROPENE;ALLYLCYCLOHEXANE;1-Allylcyclohexane;Allylcyclohexane 96%;(2-propenyl)cyclohexane;1-Cyclohexyl-2-propene
• CAS NO: 2114-42-3
• Molecular Formula: C₉H₁₆
• Molecular Weight: 124.22
• EINECS: 218-316-4
• Product Categories: monomer;Acyclic;Alkenes;Organic Building Blocks
• Mol File: 2114-42-3.mol
• Article Data: 28

Chemical Properties

• Melting Point: 330 °C
• Boiling Point: 153-154°C
• Flash Point: 31°C
• Appearance: /
• Density: 0,813 g/cm3
• Vapor Pressure: 4.43mmHg at 25°C
• Refractive Index: 1.4530
• BRN: 2037346
• CAS DataBase Reference: ALLYLCYCLOHEXANE(CAS DataBase Reference)
• NIST Chemistry Reference: ALLYLCYCLOHEXANE(2114-42-3)
• EPA Substance Registry System: ALLYLCYCLOHEXANE(2114-42-3)

Safety Data

• Hazard Codes: Xn
• Statements: 11-41-22-10
• Safety Statements: 3/7-9-16-29-33-39-26
• RIDADR: 3295
• WGK Germany: 3
• HazardClass: 3
• PackingGroup: II
• Hazardous Substances Data: 2114-42-3(Hazardous Substances Data)

Usage

Synthesis Reference(s)

Journal of the American Chemical Society, 104, p. 5829, 1982 DOI: 10.1021/ja00385a066The Journal of Organic Chemistry, 39, p. 1168, 1974 DOI: 10.1021/jo00922a037Tetrahedron Letters, 33, p. 4545, 1992 DOI: 10.1016/S0040-4039(00)61308-4

InChI:InChI=1/C9H16/c1-2-6-9-7-4-3-5-8-9/h2,9H,1,3-8H2

Upstream product

• 106-95-6 allyl bromide 
• 931-50-0 cyclohexylmagnesium bromide 
• 624-65-7 2-propynyl chloride 
• 110-83-8 cyclohexene 
• 108-85-0 1-bromocyclohexane 
• 5296-64-0 allyl phenyl thioether 
• 16212-05-8 (allylsulfonyl)benzene 
• 14370-82-2 allyl phenyl selenide 
• 19206-69-0 allyl diphenyl phosphate 
• 24850-33-7 allyltributylstanane 
• 556-56-9 allyl iodid 
• 24371-94-6 cyclohexylmercury chloride 
• 4143-42-4 (Z)-azomethane 
• 110-82-7 cyclohexane 

Downstream Products

• 1860-41-9 4-cyclohexylbutyraldehyde 
• 2539-75-5 1-propylcyclohexene 
• 1678-92-8 propylcyclohexane 
• 103-65-1 phenylpropane 
• 187737-37-7 propene 
• 74-85-1 ethene 
• 74-86-2 acetylene 
• 1314476-62-4 C₁₆H₂₈ 
• 1398743-18-4 3-(cyclohexylmethyl)-2-phenylquinoline 
• 1350447-15-2 (R)-1-cyclohexylallyl benzoate 
• 1398400-55-9 C₁₆H₂₀O₂ 
• 136490-39-6 (3-cyclohexylprop-1-en-2-yl)benzene 

Relevant articles and documents

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Visible-Light-Promoted Iron-Catalyzed C(sp2)–C(sp3) Kumada Cross-Coupling in Flow

A continuous-flow, visible-light-promoted method has been developed to overcome the limitations of iron-catalyzed Kumada–Corriu cross-coupling reactions. A variety of strongly electron rich aryl chlorides, previously hardly reactive, could be efficiently coupled with aliphatic Grignard reagents at room temperature in high yields and within a few minutes’ residence time, considerably enhancing the applicability of this iron-catalyzed reaction. The robustness of this protocol was demonstrated on a multigram scale, thus providing the potential for future pharmaceutical application.

Palladium-Catalyzed Electrochemical Allylic Alkylation between Alkyl and Allylic Halides in Aqueous Solution

A new route for the direct cross-coupling of alkyl and allylic halides using electrochemical technique has been developed in aqueous media under air. Catalyzed by Pd(OAc)2, the Zn-mediated allylic alkylations proceed smoothly between a full range of alkyl halides (primary, secondary, and tertiary) and substituted allylic halides. Protection-deprotection of acidic hydrogen in the substrates is avoided.