8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Base Information

Chemical Name:8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
CAS No.:776328-39-3
Molecular Formula:C11H9 N O
Molecular Weight:171.199
Hs Code.:2926909090
DSSTox Substance ID:DTXSID90459003
Mol file:776328-39-3.mol

Synonyms:776328-39-3;8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile;8-OXO-5,6,7,8-TETRAHYDRO-NAPHTHALENE-2-CARBONITRILE;8-oxo-6,7-dihydro-5H-naphthalene-2-carbonitrile;2-Naphthalenecarbonitrile,5,6,7,8-tetrahydro-8-oxo-;SCHEMBL4219924;DTXSID90459003;BGB32839;MFCD09029899;AKOS006291579;SB38724;BB 0262571;CS-0341486;A839148;8-oxidanylidene-6,7-dihydro-5H-naphthalene-2-carbonitrile

Suppliers and Price of 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

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

TRC
8-oxo-6,7-dihydro-5H-naphthalene-2-carbonitrile
100mg
$ 175.00

TRC
8-oxo-6,7-dihydro-5H-naphthalene-2-carbonitrile
50mg
$ 110.00

Crysdot
8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile 95+%
1g
$ 446.00

Chemenu
8-Oxo-5,6,7,8-tetrahydro-naphthalene-2-carbonitrile 95%
1g
$ 421.00

American Custom Chemicals Corporation
7-CYANO-3,4-DIHYDRO-2H-NAPHTHALEN-1-ONE 95.00%
5MG
$ 495.37

Alichem
8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile
1g
$ 454.50

Total 8 raw suppliers

Chemical Property of 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Chemical Property:

PSA：40.86000
LogP:2.07728
XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:171.068413911
Heavy Atom Count:13
Complexity:263

Purity/Quality:

97% ^*data from raw suppliers

8-oxo-6,7-dihydro-5H-naphthalene-2-carbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2=C(C=C(C=C2)C#N)C(=O)C1

Technology Process of 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

There total 5 articles about 8-Oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile 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: 75.0%

: potassium cyanide

: 144464-65-3
7-Trifluoromethanesulphonyloxy-1,2,3,4-tetrahydronaphthalen-1-one

: 776328-39-3
8-oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Guidance literature:: bis(triphenylphosphine)nickel(II) chloride; triphenylphosphine; zinc; In acetonitrile; at 70 ℃; for 4h; Inert atmosphere;

Reference yield: 67.0%

: 151-50-8
potassium cyanide

: 144464-65-3
7-Trifluoromethanesulphonyloxy-1,2,3,4-tetrahydronaphthalen-1-one

: 776328-39-3
8-oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Guidance literature:: With triphenylphosphine; zinc; bis(triphenylphosphine)nickel(II) chloride; In acetonitrile; at 60 ℃; for 2h;
DOI:10.1021/jm049600p

Reference yield:

: 22009-38-7
7-hydroxy-1-tetralone

: 776328-39-3
8-oxo-5,6,7,8-tetrahydronaphthalene-2-carbonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 2,6-dimethylpyridine / dmap / dichloromethane / 4.08 h / -40 - 20 °C

2: triphenylphosphine; zinc; bis(triphenylphosphine)nickel(II) chloride / acetonitrile / 4 h / 70 °C / Inert atmosphere

With 2,6-dimethylpyridine; dmap; bis(triphenylphosphine)nickel(II) chloride; triphenylphosphine; zinc; In dichloromethane; acetonitrile;