1-Methylcyclohexane-1-carbonitrile

Base Information

Chemical Name:1-Methylcyclohexane-1-carbonitrile
CAS No.:62718-34-7
Molecular Formula:C8H13N
Molecular Weight:123.198
Hs Code.:
European Community (EC) Number:872-650-0
DSSTox Substance ID:DTXSID30511674
Nikkaji Number:J3.218.924E

Synonyms:1-methylcyclohexane-1-carbonitrile;1-methylcyclohexanecarbonitrile;62718-34-7;SCHEMBL860505;DTXSID30511674;KYVFVCXSNCUBTI-UHFFFAOYSA-N;1-methyl-cyclohexane-1-carbonitrile;AKOS014320037;AS-43384;CS-0230953;EN300-106350;Z1255495336

Suppliers and Price of 1-Methylcyclohexane-1-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
1-Methylcyclohexanecarbonitrile
100mg
$ 265.00

Crysdot
1-Methylcyclohexanecarbonitrile 97%
1g
$ 727.00

AK Scientific
1-Methylcyclohexane-1-carbonitrile
100mg
$ 283.00

Total 4 raw suppliers

Chemical Property of 1-Methylcyclohexane-1-carbonitrile

Chemical Property:

Boiling Point:181-182 °C
PSA：23.79000
Density:0.90±0.1 g/cm3(Predicted)
LogP:2.48038
XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:123.104799419
Heavy Atom Count:9
Complexity:134

Purity/Quality:

98% ^*data from raw suppliers

1-Methylcyclohexanecarbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCCCC1)C#N

Technology Process of 1-Methylcyclohexane-1-carbonitrile

There total 10 articles about 1-Methylcyclohexane-1-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: 99.0%

: 14064-13-2
(1-methylcyclohexyl)methanol

: 62718-34-7
1-methylcyclohexanecarbonitrile

Guidance literature:: (1-methylcyclohexyl)methanol; With 2,2,6,6-Tetramethyl-1-piperidinyloxy free radical; 1,3-Diiodo-5,5-dimethyl-2,4-imidazolidinedione; In dichloromethane; at 20 ℃; for 1h; Inert atmosphere;

With ammonia; iodine; In dichloromethane; water; at 20 ℃; for 3h; Inert atmosphere;
DOI:10.1055/s-0033-1338489

Reference yield: 80.0%

: 590-67-0
1-Methylcyclohexanol

: 143-33-9,25596-52-5
sodium cyanide

: 62718-34-7
1-methylcyclohexanecarbonitrile

Guidance literature:: With chloro-trimethyl-silane; sodium iodide; In N,N-dimethyl-formamide; acetonitrile; at 60 - 65 ℃; for 5h;
DOI:10.1021/jo00327a034