5-Amino-8-hydroxy-1,4-naphthoquinone

Base Information

• Chemical Name: 5-Amino-8-hydroxy-1,4-naphthoquinone
• CAS No.: 68217-36-7
• Molecular Formula: C10H7NO3
• Molecular Weight: 189.17
• DSSTox Substance ID: DTXSID90987730
• Nikkaji Number: J1.187.962D,J1.408.569F,J1.408.570J,J635.965E
• Wikidata: Q82976053
• Mol file: 68217-36-7.mol

Synonyms:5,8-ANQ cpd;5-amino-8-hydroxy-1,4-naphthoquinone

Chemical Property of 5-Amino-8-hydroxy-1,4-naphthoquinone

Chemical Property:

• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 189.042593085
• Heavy Atom Count: 14
• Complexity: 311

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C2C(=O)C=CC(=O)C2=C1N)O

Technology Process of 5-Amino-8-hydroxy-1,4-naphthoquinone

There total 1 articles about 5-Amino-8-hydroxy-1,4-naphthoquinone 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:

1,5-dinitronaphthalene (605-71-0) → 5-amino-2,8-dihydroxy-1,4-naphthoquinone (500733-87-9) + 5-amino-8-hydroxy-[1,4]naphthoquinone (68217-36-7)

Guidance literature:

With sulfuric acid; water; sulfur; for 19.2h;

DOI:10.1016/j.mrgentox.2007.11.003

Reference yield: 95.0%

5-amino-8-hydroxy-[1,4]naphthoquinone (68217-36-7) + benzoyl chloride (98-88-4) → 5-benzoylamino-8-hydroxy-1,4-naphthoquinone (102626-26-6)

Guidance literature:

In 1,4-dioxane; for 1h; Heating;

DOI:10.1055/s-1985-31347

Reference yield: 84.0%

5-amino-8-hydroxy-[1,4]naphthoquinone (68217-36-7) + benzylamine (100-46-9) → 5-amino-3-benzilamino-8-hidroxi-1,4-naftoquinona

Guidance literature:

With pyridine; at 47 ℃; for 103.2h;

upstream raw materials:

1,5-dinitronaphthalene

Downstream raw materials:

5-hydroxynaphtho-1,4-quinone

5-chloro-8-hydroxynaphthalene-1,4-dione

5,8-Dihydroxy-1,4-naphthoquinone

5-benzoylamino-8-hydroxy-1,4-naphthoquinone