Confoline

Base Information

• Chemical Name: Confoline
• CAS No.: 76971-33-0
• Molecular Formula: C₁₇H₂₁NO₅
• Molecular Weight: 319.357
• DSSTox Substance ID: DTXSID901345755
• Mol file: 76971-33-0.mol

Synonyms:Confoline;76971-33-0;DTXSID901345755;STL564858;AKOS030493395;(1R,5S)-8-formyl-8-azabicyclo[3.2.1]oct-3-yl 3,4-dimethoxybenzoate

Chemical Property of Confoline

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 319.14197277
• Heavy Atom Count: 23
• Complexity: 429

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=C(C=C(C=C1)C(=O)OC2CC3CCC(C2)N3C=O)OC
• Isomeric SMILES: COC1=C(C=C(C=C1)C(=O)OC2C[C@H]3CC[C@@H](C2)N3C=O)OC

Technology Process of Confoline

There total 1 articles about Confoline 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:

Methyl formate (107-31-3) + convolvine (537-30-4,307974-65-8) → confoline (76971-33-0)

Guidance literature:

for 5h; Heating;

DOI:10.1007/BF00571045

Reference yield:

confoline (76971-33-0) → Veratric acid (93-07-2)

Guidance literature:

With potassium hydroxide; In methanol; for 5h; Heating;

DOI:10.1007/BF00571045

Reference yield:

confoline (76971-33-0) → convolvine (537-30-4,307974-65-8)

Guidance literature:

With hydrogen bromide; In methanol; for 3h; Heating;

DOI:10.1007/BF00571045

upstream raw materials:

Methyl formate

convolvine

Downstream raw materials:

convolvine

Veratric acid