Allylcyclopentane

Base Information

• Chemical Name: Allylcyclopentane
• CAS No.: 3524-75-2
• Molecular Formula: C8H14
• Molecular Weight: 110.199
• Hs Code.: 29021900
• European Community (EC) Number: 222-542-9
• NSC Number: 74152
• UNII: CKL3Z8PQ4A
• DSSTox Substance ID: DTXSID20188733
• Nikkaji Number: J114.098A
• Wikipedia: Allylcyclopentane
• Wikidata: Q4733439
• Mol file: 3524-75-2.mol

Synonyms:Allylcyclopentane;3524-75-2;Prop-2-enylcyclopentane;3-Cyclopentyl-1-propene;3-Cyclopentylpropene;Cyclopentane, allyl-;Cyclopentane, 2-propenyl-;Allyl cyclopentane;1-Propene, 3-cyclopentyl-;CKL3Z8PQ4A;(prop-2-en-1-yl)cyclopentane;EINECS 222-542-9;NSC-74152;2-propen-1-ylcyclopentane;NSC74152;Allylcyclopentane, 97%;(2-Propenyl)cyclopentane;UNII-CKL3Z8PQ4A;Cyclopentane, 2-propen-1-yl-;DTXSID20188733;NSC 74152;AKOS017342871;AS-81502;FT-0615574;Q4733439

Chemical Property of Allylcyclopentane

Chemical Property:

• Appearance/Colour: Clear pale yellow liquid
• Vapor Pressure: 14.5mmHg at 25°C
• Melting Point: -111 °C
• Refractive Index: 1.4410
• Boiling Point: 125.9 °C at 760 mmHg
• Flash Point: 12.2 °C
• PSA: 0.00000
• Density: 0.799 g/cm³
• LogP: 2.75270
• Storage Temp.: Flammables area
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 110.109550447
• Heavy Atom Count: 8
• Complexity: 68.1

Purity/Quality:

98% ^*data from raw suppliers

Allylcyclopentane ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,F
• Hazard Codes: F,Xn
• Statements: 11-20/21/22
• Safety Statements: 3/7-9-16-29-33-7

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC1CCCC1

Technology Process of Allylcyclopentane

There total 8 articles about Allylcyclopentane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

ethene (74-85-1) → 1-hexene (592-41-6,25067-06-5) + 1-dodecene (112-41-4,25067-08-7,62132-67-6) + oct-1-ene (111-66-0,25068-25-1) + 1-Decene (872-05-9,17438-89-0,25189-70-2) + methylenecyclopentane (1528-30-9) + methyl-cyclopentane (96-37-7) + n-propylcyclopentane (2040-96-2) + n-pentylcyclopentane (3741-00-2) + heptylcyclopentane (5617-42-5) + allylcyclopentane (3524-75-2) + 7-cyclopentyl-1-heptene (51255-64-2) + C10H18

Guidance literature:

With chromium(III) acetylacetonate; 2-(diphenylphosphino)-3-methylphosphinine; In chlorobenzene; at 60 ℃; for 0.5h; Reagent/catalyst; Schlenk technique;

DOI:10.1021/acs.organomet.8b00063

Reference yield:

bromopentene (1119-51-3) → 1,5-Hexadien (592-42-7) + allylcyclopentane (3524-75-2) + cyclopentene (142-29-0)

Guidance literature:

With magnesium; at 600 ℃; under 0.01 - 0.1 Torr; Title compound not separated from byproducts;

DOI:10.1039/b108663d

Reference yield:

allyl bromide (106-95-6) + cyclopentylmagnesium bromide (33240-34-5) → allylcyclopentane (3524-75-2)

Guidance literature:

With diethyl ether; Siedetemperatur;

DOI:10.1021/ja01210a056

upstream raw materials:

allyl bromide

cyclopentylmagnesium bromide

3-chloroprop-1-ene

tricyclopentylborane

Downstream raw materials:

(3-bromo-propyl)-cyclopentane

1-propylcyclopentene

(E)-prop-1-en-1-ylcyclopentane

(Z)-1,4-diphenylbut-2-ene