3-Methoxyphenyl acetate

Base Information

• Chemical Name: 3-Methoxyphenyl acetate
• CAS No.: 5451-83-2
• Molecular Formula: C9H10O3
• Molecular Weight: 166.177
• Hs Code.: 2915390090
• European Community (EC) Number: 653-999-6
• NSC Number: 21867
• UNII: AZT3CM4JSI
• DSSTox Substance ID: DTXSID40202925
• Nikkaji Number: J139.788E
• Wikidata: Q83076282
• Mol file: 5451-83-2.mol

Synonyms:3-Methoxyphenyl acetate;5451-83-2;1-Acetoxy-3-methoxybenzene;(3-methoxyphenyl) acetate;Phenol, 3-methoxy-, acetate;m-Methoxyphenyl acetate;m-Acetoxyanisole;m-Anisyl acetate;Phenol, m-methoxy-, acetate;AZT3CM4JSI;acetic acid 3-methoxyphenyl ester;NSC-21867;UNII-AZT3CM4JSI;3-Methoxyphenol, acetate;1-acetoxy-3-methoxy-benzene;SCHEMBL361383;DTXSID40202925;QQYNGKGFOZQMHD-UHFFFAOYSA-N;NSC21867;acetic acid (3-methoxyphenyl) ester;NSC 21867;AKOS015890131;PHENOL, 3-METHOXY-, 1-ACETATE;3-AMINO-4-CHLOROPHENYLBORONICACID;FT-0616007;A830222;InChI=1/C9H10O3/c1-7(10)12-9-5-3-4-8(6-9)11-2/h3-6H,1-2H

Chemical Property of 3-Methoxyphenyl acetate

Chemical Property:

• Vapor Pressure: 0.0254mmHg at 25°C
• Refractive Index: 1.497
• Boiling Point: 247.6 °C at 760 mmHg
• Flash Point: 97.1 °C
• PSA: 35.53000
• Density: 1.099 g/cm³
• LogP: 1.62050
• Storage Temp.: 2-8°C
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 166.062994177
• Heavy Atom Count: 12
• Complexity: 156

Purity/Quality:

99% ^*data from raw suppliers

1-Acetoxy-3-methoxybenzene 97% ^*data from reagent suppliers

Safty Information:

• Safety Statements: S24/25:Avoid contact with skin and eyes.

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=CC=CC(=C1)OC

Technology Process of 3-Methoxyphenyl acetate

There total 18 articles about 3-Methoxyphenyl 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: 98.7%

O-methylresorcine (150-19-6) + acetyl chloride (75-36-5) → acetic acid 3-methoxyphenyl ester (5451-83-2)

Guidance literature:

In cyclohexane; at 15 - 30 ℃; for 2h;

Reference yield: 98.4%

O-methylresorcine (150-19-6) + acetic acid (64-19-7,77671-22-8) → acetic acid 3-methoxyphenyl ester (5451-83-2)

Guidance literature:

In cyclohexane; at 15 - 30 ℃; for 2h;

Reference yield: 98.0%

O-methylresorcine (150-19-6) + acetic anhydride (108-24-7) → acetic acid 3-methoxyphenyl ester (5451-83-2)

Guidance literature:

With H₃[P(Mo₃O₁₀)4]*nH₂O; at 20 ℃; for 0.116667h;

DOI:10.1055/s-2007-1000859

upstream raw materials:

O-methylresorcine

acetic anhydride

acetyl chloride

1-(3-Methoxyphenyl)ethanone

Downstream raw materials:

3-phenyl-7-methoxycoumarin

2',4'-dihydroxy-4-acetophenone

1-(2-hydroxy-4-methoxyphenyl)ethanone

1-(4-hydroxy-2-methoxy-phenyl)ethanone