1-Methoxynaphthalen-4-YL acetate

Base Information

• Chemical Name: 1-Methoxynaphthalen-4-YL acetate
• CAS No.: 68716-07-4
• Molecular Formula: C13H12O3
• Molecular Weight: 216.236
• DSSTox Substance ID: DTXSID20501281
• Nikkaji Number: J1.687.578C
• Wikidata: Q82353556
• Mol file: 68716-07-4.mol

Synonyms:1-METHOXYNAPHTHALEN-4-YL ACETATE;68716-07-4;4-Methoxynaphthalen-1-yl acetate;(4-methoxynaphthalen-1-yl) acetate;acetic acid (4-methoxy-1-naphthalenyl) ester;1-Acetoxy-4-methoxynaphthalene;SCHEMBL9195639;1-Methoxy-4-acetoxy-naphthalin;1 -Acetoxy-4-methoxynaphthalene;AMY7802;DTXSID20501281;ZKJGSANFMVMFTI-UHFFFAOYSA-N;A836222

Chemical Property of 1-Methoxynaphthalen-4-YL acetate

Chemical Property:

• PSA: 35.53000
• LogP: 2.77370
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 216.078644241
• Heavy Atom Count: 16
• Complexity: 252

Purity/Quality:

99% ^*data from raw suppliers

1-METHOXYNAPHTHALEN-4-YL ACETATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC=C(C2=CC=CC=C21)OC

Technology Process of 1-Methoxynaphthalen-4-YL acetate

There total 3 articles about 1-Methoxynaphthalen-4-YL acetate 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:

diethyl 2-phenylmalonate (83-13-6) → 4-methoxynaphthalen-1-yl acetate (68716-07-4) + tetraethyl 1,2-diphenyl-1,1,2,2-ethanetetracarboxylate (117720-83-9) + 2-Acetoxy-2-phenyl-malonic acid diethyl ester

Guidance literature:

With sodium acetate; manganese triacetate; 1-Methoxynaphthalene; In acetic acid; at 80 ℃; for 4h; Yield given. Yields of byproduct given;

DOI:10.1021/jo00272a046

Reference yield:

Mangantriacetat + diethyl 2-(4-methoxyphenyl)malonate (23197-67-3) → 4-methoxynaphthalen-1-yl acetate (68716-07-4) + diethyl α-acetoxy-α-(4-methoxyphenyl)malonate (117720-81-7)

Guidance literature:

With sodium acetate; 1-Methoxynaphthalene; In acetic acid; at 80 ℃; for 4h; Yield given. Yields of byproduct given;

DOI:10.1021/jo00272a046

Reference yield:

Mangantriacetat + diethyl 2-phenylmalonate (83-13-6) → 4-methoxynaphthalen-1-yl acetate (68716-07-4) + tetraethyl 1,2-diphenyl-1,1,2,2-ethanetetracarboxylate (117720-83-9) + 2-Acetoxy-2-phenyl-malonic acid diethyl ester

Guidance literature:

With sodium acetate; 1-Methoxynaphthalene; In acetic acid; at 80 ℃; for 4h; Yield given. Yields of byproduct given;

DOI:10.1021/jo00272a046

upstream raw materials:

diethyl 2-phenylmalonate

diethyl 2-(4-methoxyphenyl)malonate

Downstream raw materials:

1,4-dimethoxynaphthalene

1-hydroxy-2-acetonaphthone

1-hydroxy-2-naphthyl cyclohexyl ketone

1-(1-hydroxy-4-methoxynaphthalen-2-yl)ethanone

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