4-Pentylbicyclo[2.2.2]octan-1-OL

Base Information

Chemical Name:4-Pentylbicyclo[2.2.2]octan-1-OL
CAS No.:76921-55-6
Molecular Formula:C13H24 O
Molecular Weight:196.33
Hs Code.:2906199090
DSSTox Substance ID:DTXSID50391273
Wikidata:Q72500132
Mol file:76921-55-6.mol

Synonyms:4-PENTYLBICYCLO[2.2.2]OCTAN-1-OL;76921-55-6;starbld0007690;SCHEMBL1991230;DTXSID50391273;HMS1608C21;AKOS001567813;4-Pentylbicyclo[2.2.2]octan-1-ol, 99%;EU-0001339;SR-01000398874;SR-01000398874-1

Suppliers and Price of 4-Pentylbicyclo[2.2.2]octan-1-OL

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 5 raw suppliers

Chemical Property of 4-Pentylbicyclo[2.2.2]octan-1-OL

Chemical Property:

Melting Point:55-56℃ (cyclohexane )
Boiling Point:260.1±8.0℃ (760 Torr)
Flash Point:107.8±10.9℃
PSA：20.23000
Density:0.998±0.06 g/cm3 (20 ºC 760 Torr)
LogP:3.65200
XLogP3:3.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:4
Exact Mass:196.182715385
Heavy Atom Count:14
Complexity:173

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCC12CCC(CC1)(CC2)O

Technology Process of 4-Pentylbicyclo[2.2.2]octan-1-OL

There total 6 articles about 4-Pentylbicyclo[2.2.2]octan-1-OL 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: 82.7%

: 76921-60-3
1-hydroxy-4-pentylbicyclo<2.2.2>octan-3-one

: 76921-55-6
1-hydroxy-4-pentylbicyclo<2.2.2>octane

Guidance literature:: With potassium hydroxide; hydrazine hydrate; diethylene glycol; 1.) reflux, 5 h; 2.) 230 deg C - 240 deg C, 20 h;
DOI:10.1039/P29810000026

Reference yield:

: 111-13-7
hexyl-methyl-ketone

: 76921-55-6
1-hydroxy-4-pentylbicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 5 steps

1: 46 percent / benzyltrimethylammonium hydroxide / methanol; 2-methyl-propan-2-ol / 10 - 20 °C

2: 71 percent / sodium hydroxide, water / 10 h / Heating

3: 71 percent / acetic anhydride / 14 h / Heating

4: 56 percent / potassium hydroxide, water / 6 h / 70 °C / Heating; 7

5: 82.7 percent / 1.) hydrazine hydrate;2.) potassium hydroxide, diethylene glycol / 1.) reflux, 5 h; 2.) 230 deg C - 240 deg C, 20 h

With potassium hydroxide; sodium hydroxide; water; acetic anhydride; N-benzyl-trimethylammonium hydroxide; hydrazine hydrate; diethylene glycol; In methanol; tert-butyl alcohol;
DOI:10.1039/P29810000026

Reference yield:

: 34886-35-6
3-acetyl-1,5-dicyano-3-pentylpentane

: 76921-55-6
1-hydroxy-4-pentylbicyclo<2.2.2>octane

Guidance literature:: Multi-step reaction with 4 steps

1: 71 percent / sodium hydroxide, water / 10 h / Heating

2: 71 percent / acetic anhydride / 14 h / Heating

3: 56 percent / potassium hydroxide, water / 6 h / 70 °C / Heating; 7

4: 82.7 percent / 1.) hydrazine hydrate;2.) potassium hydroxide, diethylene glycol / 1.) reflux, 5 h; 2.) 230 deg C - 240 deg C, 20 h

With potassium hydroxide; sodium hydroxide; water; acetic anhydride; hydrazine hydrate; diethylene glycol;
DOI:10.1039/P29810000026