8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-carbonitrile

Base Information

Chemical Name:8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-carbonitrile
CAS No.:65619-85-4
Molecular Formula:C22H23NO3
Molecular Weight:349.43
Hs Code.:
DSSTox Substance ID:DTXSID20506736
Wikidata:Q82362620

Synonyms:65619-85-4;DTXSID20506736;8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-carbonitrile

Suppliers and Price of 8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-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

Total 1 raw suppliers

Chemical Property of 8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-carbonitrile

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:349.16779360
Heavy Atom Count:26
Complexity:503

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC2(CCC1(C#N)C3=CC(=CC=C3)OCC4=CC=CC=C4)OCCO2

Technology Process of 8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-carbonitrile

There total 4 articles about 8-[3-(Benzyloxy)phenyl]-1,4-dioxaspiro[4.5]decane-8-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:

: 13225-34-8
1-(3-methoxyphenyl)-4-oxocyclohexanecarbonitrile

: 65619-85-4
4-cyano-4-cyclohexanone ethylene ketal

Guidance literature:: Multi-step reaction with 3 steps

1: 93 percent / BBr₃ / CH₂Cl₂ / 4 h

2: 93 percent / p-toluenesulfonic acid (p-TSA) / benzene / 4 h / Heating

3: 1.) NaH / 1.) DMF, C₆H₆, a) RT, 15 min, b) reflux, 1 h, 2.) DMF, C₆H₆, reflux, 4 h

With boron tribromide; sodium hydride; toluene-4-sulfonic acid; In dichloromethane; benzene;
DOI:10.1021/jm00135a019

Reference yield:

: 65619-83-2
4-cyano-4-(m-hydroxyphenyl)cyclohexanone

: 65619-85-4
4-cyano-4-cyclohexanone ethylene ketal

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / p-toluenesulfonic acid (p-TSA) / benzene / 4 h / Heating

2: 1.) NaH / 1.) DMF, C₆H₆, a) RT, 15 min, b) reflux, 1 h, 2.) DMF, C₆H₆, reflux, 4 h

With sodium hydride; toluene-4-sulfonic acid; In benzene;
DOI:10.1021/jm00135a019

Reference yield:

: 100-39-0
benzyl bromide

: 65619-84-3
4-cyano-4-(m-hydroxyphenyl)cyclohexanone ethylene ketal

: 65619-85-4
4-cyano-4-cyclohexanone ethylene ketal

Guidance literature:: With sodium hydride; Yield given. Multistep reaction; 1.) DMF, C₆H₆, a) RT, 15 min, b) reflux, 1 h, 2.) DMF, C₆H₆, reflux, 4 h;
DOI:10.1021/jm00135a019