5-Oxo-2-phenylhexanenitrile

Base Information

Chemical Name:5-Oxo-2-phenylhexanenitrile
CAS No.:54248-06-5
Molecular Formula:C12H13 N O
Molecular Weight:187.241
Hs Code.:
NSC Number:177491
DSSTox Substance ID:DTXSID90306568

Synonyms:54248-06-5;5-oxo-2-phenylhexanenitrile;NSC177491;SCHEMBL13013941;DTXSID90306568;NSC-177491

Suppliers and Price of 5-Oxo-2-phenylhexanenitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 5 raw suppliers

Chemical Property of 5-Oxo-2-phenylhexanenitrile

Chemical Property:

Vapor Pressure:9.63E-05mmHg at 25°C
Boiling Point:338.7°Cat760mmHg
Flash Point:158.7°C
Density:1.042g/cm³
XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:187.099714038
Heavy Atom Count:14
Complexity:232

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)CCC(C#N)C1=CC=CC=C1

Technology Process of 5-Oxo-2-phenylhexanenitrile

There total 3 articles about 5-Oxo-2-phenylhexanenitrile 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: 85.0%

: 140-29-4
phenylacetonitrile

: 78-94-4,25038-87-3
methyl vinyl ketone

: 54248-06-5
5-oxo-2-phenylhexanenitrile

Guidance literature:: carbonylhydridetris(triphenylphosphine)rhodium(I); In toluene; at 20 ℃; for 3h; Product distribution; other Michael acceptors, various temperatures, without toluene;
DOI:10.1016/0040-4039(91)85092-J