({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene

Base Information

Chemical Name:({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene
CAS No.:647035-19-6
Molecular Formula:C21H36O
Molecular Weight:304.51000
Hs Code.:
DSSTox Substance ID:DTXSID80514539
Wikidata:Q82374924

Synonyms:647035-19-6;({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene;DTXSID80514539

Suppliers and Price of ({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene

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 0 raw suppliers

Chemical Property of ({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene

Chemical Property:

PSA：9.23000
LogP:6.61610
XLogP3:7.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:13
Exact Mass:304.276615768
Heavy Atom Count:22
Complexity:232

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCCCC(C)CCCC(C)COCC1=CC=CC=C1
Isomeric SMILES:CCCCCC[C@H](C)CCC[C@H](C)COCC1=CC=CC=C1

Technology Process of ({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene

There total 7 articles about ({[(2S,6S)-2,6-Dimethyldodecyl]oxy}methyl)benzene 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: 90.8%

: 109-65-9
1-bromo-butane

: 647035-18-5
(+)-(3R,7S)-8-benzyloxy-3,7-dimethyloctyl-1-p-toluenesulfonate

: 647035-19-6
(+)-(2S,6S)-1-benzyloxy-2,6-dimethyldodecane

Guidance literature:: 1-bromo-butane; With magnesium; In diethyl ether; at 20 ℃; for 6h;

(+)-(3R,7S)-8-benzyloxy-3,7-dimethyloctyl-1-p-toluenesulfonate; With dilithium tetrachlorocuprate; In tetrahydrofuran; diethyl ether; at -78 - 20 ℃; for 12h;
DOI:10.1016/j.tetasy.2003.09.030

Reference yield:

: 647035-13-0
(-)-(1R,4S,8S)-9-benzyloxy-p-menthan-3-one

: 647035-19-6
(+)-(2S,6S)-1-benzyloxy-2,6-dimethyldodecane

Guidance literature:: Multi-step reaction with 6 steps

1.1: 76 percent / m-CPBA; NaHCO₃ / CH₂Cl₂ / 20 °C

2.1: 91.3 percent / H₂SO₄ / Heating

3.1: 80.5 percent / pyridine; DMAP / CHCl₃ / 0 °C

4.1: 69.2 percent / LiAlH₄ / diethyl ether / 20 °C

5.1: 96.8 percent / pyridine; DMAP / CHCl₃ / 0 °C

6.1: Mg / diethyl ether / 6 h / 20 °C

6.2: 90.8 percent / Li₂CuCl₄ / diethyl ether; tetrahydrofuran / 12 h / -78 - 20 °C

With pyridine; dmap; lithium aluminium tetrahydride; sulfuric acid; sodium hydrogencarbonate; magnesium; 3-chloro-benzenecarboperoxoic acid; In diethyl ether; dichloromethane; chloroform; 1.1: Bayer-Villiger oxidation;
DOI:10.1016/j.tetasy.2003.09.030

Reference yield:

: 647035-17-4
(+)-(3R,7S)-8-benzyloxy-3,7-dimethyloctan-1-ol

: 647035-19-6
(+)-(2S,6S)-1-benzyloxy-2,6-dimethyldodecane

Guidance literature:: Multi-step reaction with 2 steps

1.1: 96.8 percent / pyridine; DMAP / CHCl₃ / 0 °C

2.1: Mg / diethyl ether / 6 h / 20 °C

2.2: 90.8 percent / Li₂CuCl₄ / diethyl ether; tetrahydrofuran / 12 h / -78 - 20 °C

With pyridine; dmap; magnesium; In diethyl ether; chloroform;
DOI:10.1016/j.tetasy.2003.09.030