1-Cyano-7-methylnaphthalene

Base Information

Chemical Name:1-Cyano-7-methylnaphthalene
CAS No.:38879-97-9
Molecular Formula:C12H9N
Molecular Weight:167.20656
Hs Code.:
DSSTox Substance ID:DTXSID10452935
Nikkaji Number:J1.224.246H
Wikidata:Q82273840
Mol file:38879-97-9.mol

Synonyms:1-Cyano-7-methylnaphthalene;38879-97-9;7-methylnaphthalene-1-carbonitrile;7-Methyl-1-naphthonitrile;SCHEMBL15704191;DTXSID10452935;AKOS006309009;FT-0762568

Suppliers and Price of 1-Cyano-7-methylnaphthalene

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

Alichem
1-Cyano-7-methylnaphthalene
1g
$ 1819.80

Alichem
1-Cyano-7-methylnaphthalene
500mg
$ 1058.40

Total 5 raw suppliers

Chemical Property of 1-Cyano-7-methylnaphthalene

Chemical Property:

Boiling Point:324.5±11.0 °C(Predicted)
Density:1.11±0.1 g/cm3(Predicted)
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:167.073499291
Heavy Atom Count:13
Complexity:225

Purity/Quality:

99% ^*data from raw suppliers

1-Cyano-7-methylnaphthalene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC2=C(C=CC=C2C#N)C=C1

Technology Process of 1-Cyano-7-methylnaphthalene

There total 10 articles about 1-Cyano-7-methylnaphthalene 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: 98.0%

: 7511-27-5
1-bromo-7-methylnaphthalene

: 544-92-3
copper(I) cyanide

: 38879-97-9
7-methylnaphthalene-1-carbonitrile

Guidance literature:: With 1-methyl-pyrrolidin-2-one; for 3.5h; Heating;
DOI:10.1021/jm00069a006

Reference yield: 67.0%

: 162150-56-3
3,4-dihydro-7-methylnaphthalene-1-carbonitrile

: 38879-97-9
7-methylnaphthalene-1-carbonitrile

Guidance literature:: With palladium on activated charcoal; In various solvent(s); for 2h; Heating;

Reference yield:

: 18698-97-0
ortho-bromophenylacetic acid

: 38879-97-9
7-methylnaphthalene-1-carbonitrile

Guidance literature:: Multi-step reaction with 5 steps

1: 100 percent / SOCl₂, DMF / CH₂Cl₂ / 18 h

2: 93 percent / AlCl₃ / CH₂Cl₂ / 0.25 h / -10 °C

3: 100 percent / TiCl₄ / CH₂Cl₂; tetrahydrofuran / 2 h / 0 °C

4: 70 percent / Ph₃COH, TFA / 48 h / Ambient temperature

5: 98 percent / N-methylpyrrolidinone / 3.5 h / Heating

With 1-methyl-pyrrolidin-2-one; aluminium trichloride; thionyl chloride; triphenylmethyl alcohol; titanium tetrachloride; N,N-dimethyl-formamide; trifluoroacetic acid; In tetrahydrofuran; dichloromethane;
DOI:10.1021/jm00069a006