CID 13118284

Base Information

Chemical Name:CID 13118284
CAS No.:81678-18-4
Molecular Formula:C₁₅H₂₀O₂
Molecular Weight:232.323
Hs Code.:
DSSTox Substance ID:DTXSID701316859
Metabolomics Workbench ID:47491
Nikkaji Number:J988.011I
Wikidata:Q104375853
Mol file:81678-18-4.mol

Synonyms:furanogermenone

Suppliers and Price of CID 13118284

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

American Custom Chemicals Corporation
FURANOGERMENONE 95.00%
5MG
$ 502.35

Total 3 raw suppliers

Chemical Property of CID 13118284

Chemical Property:

Vapor Pressure:5.69E-05mmHg at 25°C
Boiling Point:346.6°C at 760 mmHg
Flash Point:162.5°C
PSA：30.21000
Density:0.992g/cm³
LogP:3.61830
XLogP3:3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:232.146329876
Heavy Atom Count:17
Complexity:319

Purity/Quality:: FURANOGERMENONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCC=C(CC2=C(CC1=O)C(=CO2)C)C
Isomeric SMILES:C[C@H]1CC/C=C(/CC2=C(CC1=O)C(=CO2)C)\C

Technology Process of CID 13118284

There total 10 articles about CID 13118284 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: 76.0%

: 81678-31-1,81678-32-2
(E)-(S)-3,6,10-Trimethyl-4,5,6,7,8,11-hexahydro-cyclodeca[b]furan-5-ol

: 81678-18-4
3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-5-one

Guidance literature:: With pyridinium chlorochromate;

Reference yield:

: 1416546-02-5
(5R,6S)-3,6-dimethyl-6-vinyl-4,5,6,7-tetrahydrobenzofuran-5-ol

: 84939-51-5
3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-5-one

: 81678-18-4
3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-5-one

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydrogencarbonate; Dess-Martin periodane / dichloromethane / 0.25 h / 0 °C / Inert atmosphere

2.1: tert.-butyl lithium / diethyl ether / Inert atmosphere

2.2: 0.25 h / -78 °C / Inert atmosphere

3.1: toluene / 7 h / 120 °C / Inert atmosphere

With tert.-butyl lithium; sodium hydrogencarbonate; Dess-Martin periodane; In diethyl ether; dichloromethane; toluene; 3.1: |Oxy-Cope Rearrangement;
DOI:10.1021/ol3031999

Reference yield:

: 1416546-04-7
(S)-3,6-dimethyl-6-vinyl-6,7-dihydrobenzofuran-5(4H)-one

: 84939-51-5
3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-5-one

: 81678-18-4
3,6,10-trimethyl-6,7,8,11-tetrahydro-4H-cyclodeca[b]furan-5-one

Guidance literature:: Multi-step reaction with 2 steps

1.1: tert.-butyl lithium / diethyl ether / Inert atmosphere

1.2: 0.25 h / -78 °C / Inert atmosphere

2.1: toluene / 7 h / 120 °C / Inert atmosphere

With tert.-butyl lithium; In diethyl ether; toluene; 2.1: |Oxy-Cope Rearrangement;
DOI:10.1021/ol3031999