1-(3,3-Dimethyl-2-methylidenebutoxy)-4-methoxybenzene

Base Information

• Chemical Name: 1-(3,3-Dimethyl-2-methylidenebutoxy)-4-methoxybenzene
• CAS No.: 93570-41-3
• Molecular Formula: C14H20O2
• Molecular Weight: 220.3074
• NSC Number: 86615
• DSSTox Substance ID: DTXSID50292978
• Wikidata: Q82031510

Synonyms:93570-41-3;1-(3,3-dimethyl-2-methylidenebutoxy)-4-methoxybenzene;NSC86615;DTXSID50292978;NSC-86615

Chemical Property of 1-(3,3-Dimethyl-2-methylidenebutoxy)-4-methoxybenzene

Chemical Property:

• Vapor Pressure: 0.00158mmHg at 25°C
• Boiling Point: 304.4°C at 760 mmHg
• Flash Point: 108.7°C
• Density: 0.951g/cm³
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 220.146329876
• Heavy Atom Count: 16
• Complexity: 219

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C)C(=C)COC1=CC=C(C=C1)OC

Technology Process of 1-(3,3-Dimethyl-2-methylidenebutoxy)-4-methoxybenzene

There total 2 articles about 1-(3,3-Dimethyl-2-methylidenebutoxy)-4-methoxybenzene 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:

2,3,3-trimethyl-2-butanol (594-83-2) → β-tert-Butylallyl-p-methoxyphenyl-aether (93570-41-3)

Guidance literature:

Multi-step reaction with 2 steps

1: (i) I₂, (ii) NBS, (PhCO)2O₂, CCl₄

2: K₂CO₃ / acetone

With potassium carbonate; In acetone;

DOI:10.1021/ja01476a021

Reference yield:

2-(bromomethyl)-3,3-dimethylbut-1-ene (3854-52-2) + 4-methoxy-phenol (150-76-5) → β-tert-Butylallyl-p-methoxyphenyl-aether (93570-41-3)

Guidance literature:

With potassium carbonate; In acetone;

DOI:10.1021/ja01476a021

Reference yield:

β-tert-Butylallyl-p-methoxyphenyl-aether (93570-41-3) → 2-(β-tert.-Butylallyl)-p-methoxyphenol (93570-71-9)

Guidance literature:

In diphenylether; at 197 ℃;

DOI:10.1021/ja01476a021

upstream raw materials:

2-(bromomethyl)-3,3-dimethylbut-1-ene

4-methoxy-phenol

2,3,3-trimethyl-2-butanol

Downstream raw materials:

2-(β-tert.-Butylallyl)-p-methoxyphenol

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