1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-

Base Information

Chemical Name:1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-
CAS No.:678967-36-7
Molecular Formula:C22H22O4
Molecular Weight:350.414
Hs Code.:
DSSTox Substance ID:DTXSID50440174
Nikkaji Number:J2.043.960B
ChEMBL ID:CHEMBL142930

Synonyms:678967-36-7;1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-;CHEMBL142930;SCHEMBL6082275;DTXSID50440174;3-[1-(4-Biphenylyl)ethenyl]-1,2,5-trioxaspiro[5.5]undecane-9-one

Suppliers and Price of 1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-

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 1 raw suppliers

Chemical Property of 1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-

Chemical Property:

XLogP3:4.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:350.15180918
Heavy Atom Count:26
Complexity:504

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=C(C1COC2(CCC(=O)CC2)OO1)C3=CC=C(C=C3)C4=CC=CC=C4

Technology Process of 1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)-

There total 3 articles about 1,2,5-Trioxaspiro[5.5]undecan-9-one, 3-(1-[1,1'-biphenyl]-4-ylethenyl)- 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: 42.0%

: 637-88-7
1,4-Cyclohexanedione

: 352287-93-5
(E)-3-([1,1'-biphenyl]-4-yl)but-2-en-1-ol

: 678967-36-7
3-(1-Biphenyl-4-yl-vinyl)-1,2,5-trioxaspiro[5.5]undec-9-one

Guidance literature:: (E)-3-([1,1'-biphenyl]-4-yl)but-2-en-1-ol; With oxygen; methylene blue; In acetonitrile; at -10 ℃; for 4h; Irradiation;

1,4-Cyclohexanedione; With hydrogenchloride; In acetonitrile; at 5 ℃; for 18h;
DOI:10.1016/j.bmc.2003.11.021

Reference yield:

: 637-88-7
1,4-Cyclohexanedione

: 610781-47-0
3-([1,1'-biphenyl]-4yl)-1-hydroxy-but-3-en-2-hydroperoxide

: 678967-36-7
3-(1-Biphenyl-4-yl-vinyl)-1,2,5-trioxaspiro[5.5]undec-9-one

Guidance literature:: With hydrogenchloride; at 5 ℃; for 18h;
DOI:10.1016/j.bmcl.2003.10.051

Reference yield:

: 352287-93-5
(E)-3-([1,1'-biphenyl]-4-yl)but-2-en-1-ol

: 678967-36-7
3-(1-Biphenyl-4-yl-vinyl)-1,2,5-trioxaspiro[5.5]undec-9-one

Guidance literature:: Multi-step reaction with 2 steps

1: O₂; methylene blue / acetonitrile / 4 h / -10 - 0 °C / Irradiation

2: aq. HCl / acetonitrile / 18 h / 5 °C

With hydrogenchloride; oxygen; methylene blue; In acetonitrile;
DOI:10.1021/jm051130r