Piperonylic acid piperonyl ester

Base Information

• Chemical Name: Piperonylic acid piperonyl ester
• CAS No.: 3005-52-5
• Molecular Formula: C16H12O6
• Molecular Weight: 300.268
• DSSTox Substance ID: DTXSID401345936
• Nikkaji Number: J354.529F
• Wikidata: Q63392785
• Mol file: 3005-52-5.mol

Synonyms:Piperonylic acid piperonyl ester;3005-52-5;1,3-benzodioxol-5-ylmethyl 1,3-benzodioxole-5-carboxylate;Oprea1_119495;Oprea1_474761;NPD7934;DTXSID401345936;STK806846;AKOS000806940;AB00291432-02;SR-01000446629;SR-01000446629-1;Q63392785;1,3-BENZODIOXOL-5-METHYL 1,3-BENZODIOXOLE-5-CARBOXYLATE;benzo[d][1,3]dioxol-5-ylmethyl benzo[d][1,3]dioxole-5-carboxylate

Chemical Property of Piperonylic acid piperonyl ester

Chemical Property:

• PSA: 63.22000
• LogP: 2.50100
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 300.06338810
• Heavy Atom Count: 22
• Complexity: 413

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CC4=C(C=C3)OCO4

Technology Process of Piperonylic acid piperonyl ester

There total 1 articles about Piperonylic acid piperonyl ester 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:

piperonol (495-76-1) → piperonal (120-57-0,30024-74-9) + benzo[d][1,3]dioxol-5-ylmethyl benzo[d][1,3]dioxole-5-carboxylate (3005-52-5)

Guidance literature:

With [Rh(1,3,4,5-tetramethylimidazole-2-ylidene)(trop₂NH)][trifluoromethanesulfonate]; potassium tert-butylate; dinitrogen monoxide; In tetrahydrofuran; water; toluene; at 50 ℃; under 750.075 Torr; Overall yield = 87 %; Overall yield = 164 mg; Schlenk technique; Molecular sieve;

DOI:10.1002/anie.201509288

upstream raw materials:

piperonol

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