1-(4-Methoxyphenyl)-2-methylpropan-2-amine

Base Information

• Chemical Name: 1-(4-Methoxyphenyl)-2-methylpropan-2-amine
• CAS No.: 56490-94-9
• Molecular Formula: C11H17NO
• Molecular Weight: 179.262
• Hs Code.: 2922299090
• European Community (EC) Number: 842-161-7
• DSSTox Substance ID: DTXSID501265070
• Nikkaji Number: J1.399.414E
• ChEMBL ID: CHEMBL149858
• Mol file: 56490-94-9.mol

Synonyms:1-(4-methoxyphenyl)-2-methylpropan-2-amine;56490-94-9;1,1-dimethyl-2-(4-methoxyphenyl)ethylamine;2-(4-Methoxy-phenyl)-1,1-dimethyl-ethylamine;SCHEMBL183751;CHEMBL149858;DTXSID501265070;BCP34530;MFCD09888583;AKOS012576694;AB54584;1,1-dimethyl-(4-methoxyphenyl)ethylamine;alpha,alpha-dimethyl-4-methoxyphenethylamine;2-(4-methoxyphenyl)-1,1-dimethylethylamine;2-methyl-1-(4-methoxyphenyl)-2-propanamine;CS-0235547;FT-0721057;1,1-dimethyl-2-(4-methoxy-phenyl)ethylamine;1,1-dimethyl-2-(4-methoxyphenyl)-ethylamine;EN300-158033;F30376;A851648;Z1117893987;1,1-Dimethyl-2-(4-methoxyphenyl)ethylamine

Chemical Property of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine

Chemical Property:

• Boiling Point: 269.4±15.0 °C(Predicted)
• PKA: 10.00±0.25(Predicted)
• PSA: 35.25000
• Density: 0.979±0.06 g/cm3(Predicted)
• LogP: 2.67530
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 179.131014166
• Heavy Atom Count: 13
• Complexity: 148

Purity/Quality:

98% ^*data from raw suppliers

1-(4-Methoxyphenyl)-2-methylpropan-2-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(CC1=CC=C(C=C1)OC)N

Technology Process of 1-(4-Methoxyphenyl)-2-methylpropan-2-amine

There total 23 articles about 1-(4-Methoxyphenyl)-2-methylpropan-2-amine 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: 65.0%

2,2-dimethyl-3-(4-methoxyphenyl)propionic acid (29206-06-2) → 1-(2-amino-2-methylpropyl)-4-methoxybenzene (56490-94-9)

Guidance literature:

2,2-dimethyl-3-(4-methoxyphenyl)propionic acid; With diphenyl phosphoryl azide; triethylamine; In toluene; at 0 - 75 ℃; for 2.75h;

With hydrogenchloride; In 1,4-dioxane; water; toluene; for 1h; Heating / reflux;

Reference yield: 28.0%

C11H15NO → 1-(2-amino-2-methylpropyl)-4-methoxybenzene (56490-94-9)

Guidance literature:

With palladium on activated charcoal; hydrogen;

DOI:10.1016/j.chempr.2020.12.002

Reference yield:

→ O-benzyl carbamate (621-84-1) + 1-(2-amino-2-methylpropyl)-4-methoxybenzene (56490-94-9)

Guidance literature:

upstream raw materials:

N-[2-(4-methoxy-phenyl)-1,1-dimethyl-ethyl]-formamide

2-(4-methoxy-phenyl)-1,1-dimethyl-ethyl isocyanate

1--1,1-dimethyl-2-(4-methoxyphenyl)ethane

4-Methoxy-(2-methyl-2-nitropropyl)benzol

Downstream raw materials:

N-[2-(4-methoxy-phenyl)-1,1-dimethyl-ethyl]-glycine nitrile

2-{(S)-2-Hydroxy-3-[2-(4-methoxy-phenyl)-1,1-dimethyl-ethylamino]-propoxy}-nicotinonitrile

2-{2-Hydroxy-3-[2-(4-methoxy-phenyl)-1,1-dimethyl-ethylamino]-propoxy}-nicotinonitrile

2-Hydroxy-5-{1-hydroxy-2-[2-(4-methoxy-phenyl)-1,1-dimethyl-ethylamino]-ethyl}-benzoic acid methyl ester