7-Octen-3-one, 2,2-dimethyl-

Base Information

Chemical Name:7-Octen-3-one, 2,2-dimethyl-
CAS No.:95664-94-1
Molecular Formula:C10H18O
Molecular Weight:154.252
Hs Code.:
DSSTox Substance ID:DTXSID90433686
Nikkaji Number:J2.158.929B
Wikidata:Q82247890

Synonyms:7-Octen-3-one, 2,2-dimethyl-;95664-94-1;2,2-Dimethyl-7-octene-3-one;DTXSID90433686;AKOS013636423

Suppliers and Price of 7-Octen-3-one, 2,2-dimethyl-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 7-Octen-3-one, 2,2-dimethyl-

Chemical Property:

Boiling Point:201.6±19.0 °C(Predicted)
PSA：17.07000
Density:0.829±0.06 g/cm3(Predicted)
LogP:2.95790
XLogP3:2.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:154.135765193
Heavy Atom Count:11
Complexity:139

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C(=O)CCCC=C

Technology Process of 7-Octen-3-one, 2,2-dimethyl-

There total 1 articles about 7-Octen-3-one, 2,2-dimethyl- 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:

: 20344-52-9
1-tert-butylcyclohexanol

: 108-94-1,11119-77-0,9003-41-2,9075-99-4
cyclohexanone

: 95664-94-1
2,2-Dimethyl-7-octen-3-one

Guidance literature:: With pyridine; lead(IV) acetate; copper diacetate; In benzene; at 80 ℃; for 2h;
DOI:10.1007/BF00960267

Reference yield: 4.0%

: 95664-94-1
2,2-Dimethyl-7-octen-3-one

: 20344-52-9
1-tert-butylcyclohexanol

: 112905-25-6,112905-30-3
1-tert-butyl-2-methylcyclopentanol

: 112905-25-6,112905-30-3
1-tert-butyl-2-methylcyclopentanol

Guidance literature:: With samarium diiodide; tert-butyl alcohol; In tetrahydrofuran; N,N,N,N,N,N-hexamethylphosphoric triamide; for 8h; Yields of byproduct given. Title compound not separated from byproducts;
DOI:10.1021/jo00109a018

Reference yield:

: 95664-94-1
2,2-Dimethyl-7-octen-3-one

: 7-(2,6-dimethylphenyl)-2,2-dimethyl-8-nonen-3-one

Guidance literature:: Multi-step reaction with 3 steps

1: tetrahydrofuran / 0 - 20 °C

2: 1.35 g / Grubbs catalyst, 2nd generation / CH₂Cl₂ / 20 h / 20 °C

3: 80 percent / Cs₂CO₃ / Pd(OAc)2; tricyclohexylphosphine / xylene / 12 h / Heating

With caesium carbonate; palladium diacetate; tricyclohexylphosphine; In tetrahydrofuran; dichloromethane; xylene;
DOI:10.1021/ja067372d