2-amino-3-chlorophenol

Base Information

• Chemical Name: 2-amino-3-chlorophenol
• CAS No.: 56962-00-6
• Molecular Formula: C6H6ClNO
• Molecular Weight: 143.573
• Hs Code.: 2922299090
• European Community (EC) Number: 809-471-4
• DSSTox Substance ID: DTXSID40600402
• Nikkaji Number: J160.864I
• Wikidata: Q82496458
• Mol file: 56962-00-6.mol

Synonyms:2-Amino-3-chlorophenol;

Chemical Property of 2-amino-3-chlorophenol

Chemical Property:

• Melting Point: 122 °C
• Boiling Point: 242.6 °C at 760 mmHg
• PKA: 8.79±0.10(Predicted)
• Flash Point: 100.5 °C
• PSA: 46.25000
• Density: 1.406 g/cm³
• LogP: 2.20900
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 143.0137915
• Heavy Atom Count: 9
• Complexity: 99.1

Purity/Quality:

97% ^*data from raw suppliers

2-Amino-3-chlorophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C(=C1)Cl)N)O

Technology Process of 2-amino-3-chlorophenol

There total 9 articles about 2-amino-3-chlorophenol 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: 92.0%

N-(2-chloro-6-methoxyphenyl)-2,2-dimethylpropionamide (934537-35-6) → 2-amino-3-chlorophenol (56962-00-6)

Guidance literature:

With hydrogen bromide; at 120 ℃;

DOI:10.1021/jm200766b

Reference yield: 88.0%

→ 2-amino-3-chlorophenol (56962-00-6)

Guidance literature:

With hydrogen; palladium(II) hydroxide; In methanol; at 20 ℃; for 120h;

Reference yield: 80.0%

2-nitro-3-chlorophenol (17802-02-7) → 2-amino-3-chlorophenol (56962-00-6)

Guidance literature:

With tin(II) chloride dihdyrate; ethanol; at 90 ℃; for 2h;

upstream raw materials:

2-nitro-3-chlorophenol

O-(m-chloro-phenyl)-hydroxylamine

1-azido-2-chlorobenzene

6-chloro-o-anisidine

Downstream raw materials:

4,6-dibromo-2,3-dichloro-phenol

2-bromo-2,2-difluoro-N-(2-hydroxy-6-chlorophenyl)acetamide

ethyl 2-(4-chlorobenzo[d]oxazol-2-yl)acetate

4-chloro-benzoxazole