4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile

Base Information

Chemical Name:4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile
CAS No.:65619-09-2
Molecular Formula:C14H15NO
Molecular Weight:213.27500
Hs Code.:2926909090
DSSTox Substance ID:DTXSID00503804
Wikidata:Q82357855
Mol file:65619-09-2.mol

Synonyms:65619-09-2;4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile;1-(2-Methylphenyl)-4-oxocyclohexane-1-carbonitrile;4-oxo-1-o-tolylcyclohexanecarbonitrile;4-oxo-1-(o-tolyl)cyclohexane-1-carbonitrile;SCHEMBL2294184;DTXSID00503804;4-Cyano-4-(2-methylphenyl)cyclohexanone;CS-0454581;FT-0734362;J-515902

Suppliers and Price of 4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile

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

Crysdot
4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile 95+%
1g
$ 551.00

Chemenu
4-oxo-1-(o-tolyl)cyclohexane-1-carbonitrile 95%
1g
$ 520.00

Alichem
4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile
1g
$ 620.10

Acrotein
4-Cyano-4-(2-methylphenyl)cyclohexanone 97%
1g
$ 330.00

Acrotein
4-Cyano-4-(2-methylphenyl)cyclohexanone 97%
0.5g
$ 183.33

Total 10 raw suppliers

Chemical Property of 4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile

Chemical Property:

PSA：40.86000
LogP:2.89948
Storage Temp.:2-8°C
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:213.115364102
Heavy Atom Count:16
Complexity:315

Purity/Quality:

99.90% ^*data from raw suppliers

4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=CC=C1C2(CCC(=O)CC2)C#N

Technology Process of 4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile

There total 5 articles about 4-Oxo-1-(o-tolyl)cyclohexanecarbonitrile 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: 78.0%

: 65619-08-1
5-cyano-2-oxo-5-o-tolyl-cyclohexanecarboxylic acid methyl ester

: 65619-09-2
4-methylphenyl-4-cyano-cyclohexanone

Guidance literature:: With sulfuric acid; In acetic acid; for 24h; Heating;
DOI:10.1021/jm00178a014

Reference yield:

: 56326-94-4
methyl 5-cyano-5-(4-chlorophenyl)-2-oxocyclohexanecarboxylate

: 65619-09-2
4-methylphenyl-4-cyano-cyclohexanone

Guidance literature:: With sulfuric acid; acetic acid; In 5-cyano-2-oxo-5-o-tolyl-cyclohexanecarboxylic acid methyl ester;

Reference yield:

: 65619-07-0
4-cyano-4-o-tolyl-heptanedioic acid dimethyl ester

: 65619-09-2
4-methylphenyl-4-cyano-cyclohexanone

Guidance literature:: Multi-step reaction with 2 steps

1: potassium tert-butylate

2: sulfuric acid; acetic acid

With sulfuric acid; potassium tert-butylate; acetic acid;