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Cubebin

Base Information Edit
  • Chemical Name:Cubebin
  • CAS No.:18423-69-3
  • Molecular Formula:C20H20O6
  • Molecular Weight:356.375
  • Hs Code.:
  • European Community (EC) Number:242-300-6
  • UNII:J237078S8A
  • DSSTox Substance ID:DTXSID101031063
  • Nikkaji Number:J941.075I
  • Wikidata:Q27134167
  • Metabolomics Workbench ID:64068
  • ChEMBL ID:CHEMBL399831
  • Mol file:18423-69-3.mol
Cubebin

Synonyms:cubebin

Suppliers and Price of Cubebin
Supply Marketing:Edit
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
  • CUBEBIN 98.00%
  • 50MG
  • $ 1374.45
Total 16 raw suppliers
Chemical Property of Cubebin Edit
Chemical Property:
  • Vapor Pressure:6.29E-12mmHg at 25°C 
  • Melting Point:131-132°C 
  • Refractive Index:1.4450 (estimate) 
  • Boiling Point:526.8°Cat760mmHg 
  • Flash Point:272.4°C 
  • PSA:66.38000 
  • Density:1.393g/cm3 
  • LogP:2.51020 
  • XLogP3:3.4
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:6
  • Rotatable Bond Count:4
  • Exact Mass:356.12598835
  • Heavy Atom Count:26
  • Complexity:487
Purity/Quality:

99% *data from raw suppliers

CUBEBIN 98.00% *data from reagent suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:

SDS file from LookChem

Useful:
  • Canonical SMILES:C1C(C(C(O1)O)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5
  • Isomeric SMILES:C1[C@@H]([C@H]([C@H](O1)O)CC2=CC3=C(C=C2)OCO3)CC4=CC5=C(C=C4)OCO5
Technology Process of Cubebin

There total 11 articles about Cubebin 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:
Guidance literature:
With diisobutylaluminium hydride; In dichloromethane; at -78 ℃; for 0.333333h;
Guidance literature:
With diisobutylaluminium hydride; In dichloromethane; cyclohexane; at -78 ℃; for 0.333333h; Overall yield = 56 %; Overall yield = 0.432 g; diastereoselective reaction; Inert atmosphere;
DOI:10.1021/acs.orglett.7b02644
Guidance literature:
Multi-step reaction with 3 steps
1.1: fetizon's reagent / toluene / 1.5 h / Inert atmosphere; Reflux
2.1: lithium diisopropyl amide / tetrahydrofuran / 0.5 h / -78 °C / Inert atmosphere
2.2: 23 h / 20 °C / Inert atmosphere
3.1: diisobutylaluminium hydride / dichloromethane; cyclohexane / 0.33 h / -78 °C / Inert atmosphere
With diisobutylaluminium hydride; lithium diisopropyl amide; In tetrahydrofuran; dichloromethane; cyclohexane; toluene;
DOI:10.1021/acs.orglett.7b02644
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