2-Propyl-1-indanone

Base Information

• Chemical Name: 2-Propyl-1-indanone
• CAS No.: 92013-10-0
• Molecular Formula: C12H14O
• Molecular Weight: 174.24
• European Community (EC) Number: 668-554-1
• DSSTox Substance ID: DTXSID10408578
• Nikkaji Number: J2.337.207J
• Mol file: 92013-10-0.mol

Synonyms:2-Propyl-2,3-dihydro-1H-inden-1-one;92013-10-0;2-PROPYL-1-INDANONE;2-propyl-2,3-dihydroinden-1-one;2-propylindan-1-one;2-propylindanone;SCHEMBL9324677;DTXSID10408578;MFCD00799578;AKOS009158840;BS-17854;CS-0152401;D84138;A844123

Chemical Property of 2-Propyl-1-indanone

Chemical Property:

• Refractive Index: n20/D 1.537(lit.)
• Boiling Point: 272.8 °C at 760 mmHg
• Flash Point: 111.7 °C
• PSA: 17.07000
• Density: 1.03 g/cm³
• LogP: 2.84170
• Storage Temp.: 2-8°C
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 174.104465066
• Heavy Atom Count: 13
• Complexity: 197

Purity/Quality:

99% ^*data from raw suppliers

2-Propyl-2,3-dihydro-1H-inden-1-one 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1CC2=CC=CC=C2C1=O

Technology Process of 2-Propyl-1-indanone

There total 4 articles about 2-Propyl-1-indanone 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:

→ 2-propylindan-1-one (92013-10-0)

Guidance literature:

With sulfuric acid;

DOI:10.1021/ja01192a061

Reference yield:

1-phenyl-2-propyl-2-propen-1-one (354529-98-9) → 2-propylindan-1-one (92013-10-0)

Guidance literature:

With sulfuric acid; at 50 - 60 ℃; for 1h;

DOI:10.1002/ejoc.200500733

Reference yield:

inden-1-one (83-33-0) → 2-propylindan-1-one (92013-10-0)

Guidance literature:

With lithium diisopropyl amide; Yield given. Multistep reaction;

DOI:10.1021/jo00196a024

upstream raw materials:

inden-1-one

1-phenyl-2-propyl-2-propen-1-one

phenyl butyl ketone

Downstream raw materials:

2-n-propyl-1H-indene

Refernces

• 1、 Adamczyk, Maciej,Watt, David S.,Netzel, Daniel A.. "Synthesis of Biological Markers in Fossil Fuels. 2. Synthesis and 13C NMR Studies of Substituted Indans and Tetralins". . p. 4226 - 4237. Retrieved 2007/10/02.