1-Allylnaphthalene

Base Information

• Chemical Name: 1-Allylnaphthalene
• CAS No.: 2489-86-3
• Molecular Formula: C13H12
• Molecular Weight: 168.238
• Hs Code.: 2902909090
• DSSTox Substance ID: DTXSID00179588
• Nikkaji Number: J100.299F
• Wikidata: Q72437319
• Mol file: 2489-86-3.mol

Synonyms:1-ALLYLNAPHTHALENE;2489-86-3;3-(1-Naphthyl)-1-propene;Naphthalene, 1-allyl-;1-prop-2-enylnaphthalene;alpha-Allylnaphthalene;Naphthalene, 1-(2-propenyl)-;1-(2-Propenyl)naphthalene;1-(prop-2-en-1-yl)naphthalene;Naphthalene, (2-propenyl)-;BRN 1927776;MFCD00021581;3-05-00-01805 (Beilstein Handbook Reference);1-(2-propenyl)-naphthalene;1-(2-propen-1-yl)-Naphthalene;.alpha.-Allylnaphthalene;DTXSID00179588;Naphthalene, 1-(2-propen-1-yl)-;3-(1-Naphthyl)-1-propene, 99%;AKOS006344680;AC-4946;CS-W014297;SB66829;DS-18514;LS-94430;FT-0634320;A18524;EN300-698376;F14947;J-504173

Chemical Property of 1-Allylnaphthalene

Chemical Property:

• Vapor Pressure: 0.0146mmHg at 25°C
• Refractive Index: 1.606
• Boiling Point: 266 °C at 760 mmHg
• Flash Point: 119.5 °C
• PSA: 0.00000
• Density: 1.001 g/cm³
• LogP: 3.56830
• Storage Temp.: 2-8°C
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 168.093900383
• Heavy Atom Count: 13
• Complexity: 171

Purity/Quality:

99% ^*data from raw suppliers

1-Allylnaphthalene ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C=CCC1=CC=CC2=CC=CC=C21

Technology Process of 1-Allylnaphthalene

There total 42 articles about 1-Allylnaphthalene 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: 99.0%

1-Naphthylboronic acid (13922-41-3) + allyl bromide (106-95-6) → 1-allylnaphthalene (2489-86-3)

Guidance literature:

With tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; potassium carbonate; In toluene; at 110 ℃; for 12h; Inert atmosphere;

DOI:10.1016/j.tet.2021.132287

Reference yield: 97.0%

1-Bromonaphthalene (90-11-9) + allyl bromide (106-95-6) → 1-allylnaphthalene (2489-86-3)

Guidance literature:

1-Bromonaphthalene; With lithium tributylmagnesate; In tetrahydrofuran; hexane; at -78 ℃;

allyl bromide; In tetrahydrofuran; hexane; at 0 ℃; for 0.5h;

DOI:10.1002/1521-3773(20000717)39:14<2481::AID-ANIE2481>3.0.CO;2-J

Reference yield: 97.0%

1-Bromonaphthalene (90-11-9) + C10H20AlNO → 1-allylnaphthalene (2489-86-3)

Guidance literature:

bis-triphenylphosphine-palladium(II) chloride; In tetrahydrofuran; at 60 ℃; for 12h;

DOI:10.1055/s-2003-41492

upstream raw materials:

allyl bromide

1-naphthylmagnesiumbromide

3-chloroprop-1-ene

1-Bromonaphthalene

Downstream raw materials:

naphthalene

benzo[c]picene

1-Methylnaphthalene

5-naphthalen-1-yl-3-phenethyl-4,5-dihydroisoxazole

Refernces

• 1、 Tiffeneau,Daudel. "-". . p. 678. Retrieved 1908.
• 2、 -. "METHOD FOR PRODUCING ARENE COMPOUNDS AND ARENE COMPOUNDS PRODUCED BY THE SAME". Paragraph 0033. . Retrieved 2021/06/26.