1'-Methoxy-2',3'-dihydrosafrole

Base Information

• Chemical Name: 1'-Methoxy-2',3'-dihydrosafrole
• CAS No.: 73455-03-5
• Molecular Formula: C11H14O3
• Molecular Weight: 194.23
• UNII: B94O6Y8R3I
• DSSTox Substance ID: DTXSID201343815
• Nikkaji Number: J3.322.926G
• Wikidata: Q27274533

Synonyms:1'-Methoxy-2',3'-dihydrosafrole;UNII-B94O6Y8R3I;B94O6Y8R3I;73455-03-5;1,3-Benzodioxole, 5-(1-methoxypropyl)-;5-(1-methoxypropyl)-1,3-benzodioxole;PBFANQACQQLPPK-UHFFFAOYSA-N;DTXSID201343815;AKOS024375887;1-(3,4-methylenedioxyphenyl)-1-methoxypropane;Q27274533

Chemical Property of 1'-Methoxy-2',3'-dihydrosafrole

Chemical Property:

• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 194.094294304
• Heavy Atom Count: 14
• Complexity: 183

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCC(C1=CC2=C(C=C1)OCO2)OC

Technology Process of 1'-Methoxy-2',3'-dihydrosafrole

There total 1 articles about 1'-Methoxy-2',3'-dihydrosafrole 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: 52.0%

5-(1-Methoxy-allyl)-benzo[1,3]dioxole (40581-87-1) → dihydrosafrole (94-58-6) + 5-(1-methoxypropyl)-1,3-benzodioxolane (73455-03-5)

Guidance literature:

With potassium hydroxide; palladium on activated charcoal; at 20 ℃; for 22h;

DOI:10.1016/j.tet.2004.05.097

Reference yield: 81.0%

5-(1-methoxypropyl)-1,3-benzodioxolane (73455-03-5) + toluene-4-sulfonamide (70-55-3) → N-(1-(benzo[d][1,3]dioxol-5-yl)propyl)-4-methylbenzenesulfonamide (652155-31-2)

Guidance literature:

With iron(III) chloride; In dichloromethane; at 20 ℃; for 0.8h; Inert atmosphere;

DOI:10.1039/c3ob27128e

Reference yield:

5-(1-methoxypropyl)-1,3-benzodioxolane (73455-03-5) + water (7732-18-5) → isosafrole (120-58-1)

Guidance literature:

at 200 ℃;

upstream raw materials:

5-(1-Methoxy-allyl)-benzo[1,3]dioxole

Downstream raw materials:

isosafrole

N-(1-(benzo[d][1,3]dioxol-5-yl)propyl)-4-methylbenzenesulfonamide

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