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Encyclopedia

Botrydial

Base Information Edit
  • Chemical Name:Botrydial
  • CAS No.:54986-75-3
  • Molecular Formula:C17H26O5
  • Molecular Weight:310.39
  • Hs Code.:
  • UNII:2VQE1Z1G8Q
  • DSSTox Substance ID:DTXSID20970337
  • Nikkaji Number:J12.832E
  • Wikipedia:Botrydial
  • Wikidata:Q4948811
  • Metabolomics Workbench ID:28404
  • ChEMBL ID:CHEMBL476877
  • Mol file:54986-75-3.mol
Botrydial

Synonyms:botrydial

Suppliers and Price of Botrydial
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
Total 8 raw suppliers
Chemical Property of Botrydial Edit
Chemical Property:
  • Vapor Pressure:5.79E-08mmHg at 25°C 
  • Boiling Point:397.4°Cat760mmHg 
  • PKA:13.73±0.70(Predicted) 
  • Flash Point:134.7°C 
  • PSA:80.67000 
  • Density:1.15g/cm3 
  • LogP:1.75540 
  • XLogP3:1.7
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:5
  • Rotatable Bond Count:4
  • Exact Mass:310.17802393
  • Heavy Atom Count:22
  • Complexity:499
Purity/Quality:

99% *data from raw suppliers

Safty Information:
  • Pictogram(s):  
  • Hazard Codes: 
MSDS Files:
Useful:
  • Canonical SMILES:CC1CC(C2C(CC(C2(C1C=O)O)(C)C=O)(C)C)OC(=O)C
  • Isomeric SMILES:C[C@@H]1C[C@@H]([C@@H]2[C@]([C@H]1C=O)([C@@](CC2(C)C)(C)C=O)O)OC(=O)C
Technology Process of Botrydial

There total 4 articles about Botrydial 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 sodium periodate; In tetrahydrofuran; water; at 20 ℃; for 12h;
DOI:10.1016/j.tet.2006.06.064
upstream raw materials:

2-benzylidine-1-indanone

Downstream raw materials:

botrydiol

botrydienal

dihydrobotrydial

dehydrobotrydienal

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