4-Amino-3-chloro-5-methylphenol

Base Information

• Chemical Name: 4-Amino-3-chloro-5-methylphenol
• CAS No.: 873417-25-5
• Molecular Formula: C7H8ClNO
• Molecular Weight: 157.60
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID60697192
• Wikidata: Q72434506
• Mol file: 873417-25-5.mol

Synonyms:4-AMINO-3-CHLORO-5-METHYLPHENOL;873417-25-5;SCHEMBL3785424;DTXSID60697192;4-Hydroxy-2-Chloro-6-Methylaniline;AKOS006345434;SB76471;EN300-370878

Chemical Property of 4-Amino-3-chloro-5-methylphenol

Chemical Property:

• PSA: 46.25000
• Density: 1.331
• LogP: 2.51740
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 157.0294416
• Heavy Atom Count: 10
• Complexity: 120

Purity/Quality:

99% ^*data from raw suppliers

4-Amino-3-chloro-5-methylphenol 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC(=C1N)Cl)O

Technology Process of 4-Amino-3-chloro-5-methylphenol

There total 2 articles about 4-Amino-3-chloro-5-methylphenol 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-chloro-4-methoxy-6-methylaniline (82477-63-2) → 4-amino-3-chloro-5-methylphenol (873417-25-5)

Guidance literature:

With hydrogen iodide;

Reference yield:

4-ethoxy-2-chloro-6-methyl-aniline (861008-01-7) → 4-amino-3-chloro-5-methylphenol (873417-25-5)

Guidance literature:

With hydrogen iodide;

Reference yield: 13.8%

4-amino-3-chloro-5-methylphenol (873417-25-5) + chloroacetyl chloride (79-04-9) → C9H9Cl2NO2

Guidance literature:

With triethylamine; In dichloromethane; for 2h; Cooling with ice;

upstream raw materials:

2-chloro-4-methoxy-6-methylaniline

4-ethoxy-2-chloro-6-methyl-aniline

Downstream raw materials:

2-chloro-6-methyl-[1,4]benzoquinone