9,10-Anthracenedione, 1-(dimethylamino)-4,8-dihydroxy-5-(methylamino)-

Base Information

• Chemical Name: 9,10-Anthracenedione, 1-(dimethylamino)-4,8-dihydroxy-5-(methylamino)-
• CAS No.: 71876-31-8
• Molecular Formula: C17H16N2O4
• Molecular Weight: 312.32
• DSSTox Substance ID: DTXSID3072452
• Nikkaji Number: J446.995J
• Wikidata: Q82000498
• Mol file: 71876-31-8.mol

Synonyms:71876-31-8;9,10-Anthracenedione, 1-(dimethylamino)-4,8-dihydroxy-5-(methylamino)-;1,5-Dihydroxy-4-dimethylamino-8-(methylamino)anthraquinone;DTXSID3072452;1-(Dimethylamino)-4,8-dihydroxy-5-(methylamino)-9,10-anthracenedione

Chemical Property of 9,10-Anthracenedione, 1-(dimethylamino)-4,8-dihydroxy-5-(methylamino)-

Chemical Property:

• Vapor Pressure: 1.35E-15mmHg at 25°C
• Boiling Point: 612.5°C at 760 mmHg
• PKA: 6.62±0.20(Predicted)
• Flash Point: 324.2°C
• PSA: 89.87000
• Density: 1.463g/cm³
• LogP: 2.05390
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 2
• Exact Mass: 312.11100700
• Heavy Atom Count: 23
• Complexity: 495

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC1=C2C(=C(C=C1)O)C(=O)C3=C(C=CC(=C3C2=O)O)N(C)C