Forosamine

Base Information

• Chemical Name: Forosamine
• CAS No.: 18423-27-3
• Molecular Formula: C8H17 N O2
• Molecular Weight: 159.228
• Hs Code.: 2922399090
• DSSTox Substance ID: DTXSID60171548
• Nikkaji Number: J16.172A
• Wikidata: Q27114982
• Metabolomics Workbench ID: 54616
• Mol file: 18423-27-3.mol

Synonyms:forosamine

Chemical Property of Forosamine

Chemical Property:

• Vapor Pressure: 0.0033mmHg at 25°C
• Boiling Point: 251°Cat760mmHg
• PKA: 14.66±0.20(Predicted)
• Flash Point: 105.6°C
• PSA: 40.54000
• Density: 0.974g/cm³
• LogP: 0.27650
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 159.125928785
• Heavy Atom Count: 11
• Complexity: 115

Purity/Quality:

99% ^*data from raw suppliers

Forosamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(CCC=O)N(C)C)O
• Isomeric SMILES: C[C@H]([C@H](CCC=O)N(C)C)O

Technology Process of Forosamine

There total 1 articles about Forosamine 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:

→ D-forosamine (18423-27-3,18423-30-8)

Guidance literature:

With sulfuric acid; at 80 ℃;

Reference yield: 39.0%

D-forosamine (18423-27-3,18423-30-8) + ortho-(cyclopropylethynyl)benzoic acid (1313028-09-9) → C20H25NO3

Guidance literature:

With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; at 20 ℃; for 20h;

DOI:10.1021/jacs.6b07585

Reference yield:

D-forosamine (18423-27-3,18423-30-8) → spinosyn A (131929-60-7) + C41H65NO10

Guidance literature:

Multi-step reaction with 2 steps

1: N-ethyl-N,N-diisopropylamine; dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride / dichloromethane / 20 h / 20 °C

2: [bis(trifluoromethanesulfonyl)imidate](triphenylphosphine)gold(I); silver trifluoromethanesulfonate / chlorobenzene / 25 h / 20 - 50 °C / Molecular sieve

With dmap; [bis(trifluoromethanesulfonyl)imidate](triphenylphosphine)gold(I); silver trifluoromethanesulfonate; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; chlorobenzene;

DOI:10.1021/jacs.6b07585

Downstream raw materials:

spinosyn A