8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one

Base Information

Chemical Name:8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one
CAS No.:41867-59-8
Molecular Formula:C₁₁H₁₆O
Molecular Weight:164.247
Hs Code.:
DSSTox Substance ID:DTXSID80509687
Mol file:41867-59-8.mol

Synonyms:41867-59-8;SCHEMBL11216359;8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one;DTXSID80509687

Suppliers and Price of 8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one

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 8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one

Chemical Property:

XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:164.120115130
Heavy Atom Count:12
Complexity:239

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCCC=C1CCCC2=O

Technology Process of 8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one

There total 1 articles about 8a-Methyl-3,4,6,7,8,8a-hexahydronaphthalen-1(2H)-one 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: 67.0%

: 77515-16-3,77515-17-4
4aα-chloro-octahydro-5β-phenylthio-8aβ-methylnaphthalen-1(2H)-one

: 41867-59-8,78743-80-3,93861-02-0
(R)-8a-Methyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one

: 77515-22-1,77515-23-2
(5R,8aR)-8a-Methyl-5-phenylsulfanyl-3,5,6,7,8,8a-hexahydro-2H-naphthalen-1-one

Guidance literature:: With 2,6-dichloro-benzonitrile; In benzene; at 60 ℃; for 10h;
DOI:10.1039/P19810000088

Reference yield:

: 41867-59-8,78743-80-3,93861-02-0
(R)-8a-Methyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one

: 77515-22-1,77515-23-2
(5S,8aR)-8a-Methyl-5-phenylsulfanyl-3,5,6,7,8,8a-hexahydro-2H-naphthalen-1-one

Guidance literature:: Multi-step reaction with 3 steps

1: 54.2 percent / m-chloroperbenzoic acid / CHCl₃ / 5 h / 0 °C

2: 66.7 percent / W-200-N alumina / diethyl ether / 0.33 h

3: 36 percent / H₂SO₄, AcOH / 4 h / Ambient temperature; other reagents under various conditions

With W-200-N alumina; sulfuric acid; acetic acid; 3-chloro-benzenecarboperoxoic acid; In diethyl ether; chloroform;
DOI:10.1039/P19810000088

Reference yield:

: 41867-59-8,78743-80-3,93861-02-0
(R)-8a-Methyl-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-one

: 77515-35-6,77550-42-6,77550-43-7
(5S,8aR)-5-Benzenesulfinyl-8a-methyl-3,5,6,7,8,8a-hexahydro-2H-naphthalen-1-one

Guidance literature:: Multi-step reaction with 4 steps

1: 54.2 percent / m-chloroperbenzoic acid / CHCl₃ / 5 h / 0 °C

2: 66.7 percent / W-200-N alumina / diethyl ether / 0.33 h

3: 36 percent / H₂SO₄, AcOH / 4 h / Ambient temperature; other reagents under various conditions

4: m-chloroperbenzoic acid / CHCl₃ / 2 h

With W-200-N alumina; sulfuric acid; acetic acid; 3-chloro-benzenecarboperoxoic acid; In diethyl ether; chloroform;
DOI:10.1039/P19810000088