3-[(1,1-Dimethylethoxy)methyl]heptane

Base Information

Chemical Name:3-[(1,1-Dimethylethoxy)methyl]heptane
CAS No.:83704-03-4
Molecular Formula:C12H26 O
Molecular Weight:186.338
Hs Code.:2909199090
European Community (EC) Number:280-522-5
DSSTox Substance ID:DTXSID301003705
Nikkaji Number:J326.836E
Mol file:83704-03-4.mol

Synonyms:3-[(1,1-DIMETHYLETHOXY)METHYL]HEPTANE;83704-03-4;3-[(2-methylpropan-2-yl)oxymethyl]heptane;EINECS 280-522-5;1-(TERT-BUTOXY)-2-ETHYLHEXANE;3-((1,1-Dimethylethoxy)methyl)heptane;3-(tert-Butoxymethyl)heptane;SCHEMBL2280801;Ether, 2-ethylhexyl tert-butyl;3-(tert-Butoxymethyl)heptane #;DTXSID301003705;AKOS037645748;AS-63021;D93004

Suppliers and Price of 3-[(1,1-Dimethylethoxy)methyl]heptane

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 17 raw suppliers

Chemical Property of 3-[(1,1-Dimethylethoxy)methyl]heptane

Chemical Property:

Vapor Pressure:0.432mmHg at 25°C
Boiling Point:201.7°C at 760 mmHg
Flash Point:63.2°C
PSA：9.23000
Density:0.798g/cm³
LogP:4.01790
XLogP3:4.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:186.198365449
Heavy Atom Count:13
Complexity:113

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCC(CC)COC(C)(C)C

Technology Process of 3-[(1,1-Dimethylethoxy)methyl]heptane

There total 2 articles about 3-[(1,1-Dimethylethoxy)methyl]heptane 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: 78.0%

: 104-76-7
2-Ethylhexyl alcohol

: 75-65-0
tert-butyl alcohol

: 83704-03-4
3-tert-butoxymethyl-heptane

Guidance literature:: With [bis(trifluoromethanesulfonyl)imidate](triphenylphosphine)gold (I); at 120 ℃; for 0.5h; Inert atmosphere; Microwave irradiation;
DOI:10.1002/adsc.201401097