1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione

Base Information

• Chemical Name: 1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione
• CAS No.: 65271-75-2
• Molecular Formula: C24H30N2O4
• Molecular Weight: 410.506
• NSC Number: 285685
• DSSTox Substance ID: DTXSID60215592
• Wikidata: Q83091654
• ChEMBL ID: CHEMBL3249118
• Mol file: 65271-75-2.mol

Synonyms:1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione;65271-75-2;9,10-Anthracenedione, 1,4-bis((5-hydroxypentyl)amino)-;NSC285685;CHEMBL3249118;DTXSID60215592;NSC 285685;NSC-285685

Chemical Property of 1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione

Chemical Property:

• Vapor Pressure: 2.88E-19mmHg at 25°C
• Boiling Point: 677.2°C at 760 mmHg
• Flash Point: 363.4°C
• Density: 1.262g/cm³
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 12
• Exact Mass: 410.22055744
• Heavy Atom Count: 30
• Complexity: 507

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(=O)C3=C(C=CC(=C3C2=O)NCCCCCO)NCCCCCO

Technology Process of 1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione

There total 3 articles about 1,4-Bis((5-hydroxypentyl)amino)-9,10-anthracenedione 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: 39.52%

leucoquinizarin (476-60-8) + 5-hydroxypentylamine (2508-29-4) → 1,4-(dihydroxypentylamino)anthracene-9,10-dione (65271-75-2)

Guidance literature:

at 100 ℃; for 4h;

Reference yield:

1,4-dihydroxy-9,10-anthracenedione (81-64-1,103220-12-8) → 1,4-(dihydroxypentylamino)anthracene-9,10-dione (65271-75-2)

Guidance literature:

DOI:10.1211/146080899128734361

Reference yield:

→ 1,4-(dihydroxypentylamino)anthracene-9,10-dione (65271-75-2)

Guidance literature:

1,4,9,10-Tetrahydroxyanthracen, entspr.Amin, Luft;

DOI:10.1021/jm00201a012

upstream raw materials:

leucoquinizarin

5-hydroxypentylamine

1,4-dihydroxy-9,10-anthracenedione