1-prop-2-enyl-1H-indene

Base Information

• Chemical Name: 1-prop-2-enyl-1H-indene
• CAS No.: 20258-77-9
• Molecular Formula: C12H12
• Molecular Weight: 156.227
• NSC Number: 62538
• DSSTox Substance ID: DTXSID80942378
• Nikkaji Number: J1.137.268F
• Mol file: 20258-77-9.mol

Synonyms:1-prop-2-enyl-1H-indene;20258-77-9;1-ALLYL-1H-INDENE;1-(prop-2-en-1-yl)-1h-indene;1H-Indene, 1-(2-propen-1-yl)-;allylindene;NSC62538;DTXSID80942378;CUTPMEVNBWCXGK-UHFFFAOYSA-N;NSC-62538

Chemical Property of 1-prop-2-enyl-1H-indene

Chemical Property:

• Vapor Pressure: 0.0389mmHg at 25°C
• Boiling Point: 248.1°C at 760 mmHg
• Flash Point: 98.7°C
• Density: 0.97g/cm³
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 156.093900383
• Heavy Atom Count: 12
• Complexity: 190

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCC1C=CC2=CC=CC=C12

Technology Process of 1-prop-2-enyl-1H-indene

There total 3 articles about 1-prop-2-enyl-1H-indene 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:

Allyl acetate (591-87-7) + 3-Trimethylsilylinden (18053-75-3) → 1-allyl-1H-indene (20258-77-9)

Guidance literature:

tetrakis(triphenylphosphine) palladium⁽⁰⁾;

DOI:10.1016/S0040-4039(00)92814-4

Reference yield:

indenyllithium (20669-47-0) + 3-chloroprop-1-ene (107-05-1) → 3-(2-propenyl)indene (2294-87-3) + 1-allyl-1H-indene (20258-77-9)

Guidance literature:

In tetrahydrofuran; at 20 ℃; for 48h;

DOI:10.1016/S0022-328X(99)00026-1

Reference yield:

allyl bromide (106-95-6) + 1-indene (95-13-6) → 3-(2-propenyl)indene (2294-87-3) + 1-allyl-1H-indene (20258-77-9)

Guidance literature:

With n-butyllithium; N,N,N,N,-tetramethylethylenediamine; Yield given. Multistep reaction. Yields of byproduct given; 1.) hexane, 0 deg C, 1 h, 2.) RT, 8 h;

DOI:10.1021/jo00141a018

upstream raw materials:

Allyl acetate

3-Trimethylsilylinden

allyl bromide

1-indene