Mitoxantrone dicarboxylic acid

Base Information

• Chemical Name: Mitoxantrone dicarboxylic acid
• CAS No.: 97729-57-2
• Molecular Formula: C22H24 N4 O8
• Molecular Weight: 472.45
• Nikkaji Number: J367.560B
• ChEMBL ID: CHEMBL3544503
• Mol file: 97729-57-2.mol

Synonyms:CL 283981;CL-283981;mitoxantrone dicarboxylic acid

Chemical Property of Mitoxantrone dicarboxylic acid

Chemical Property:

• Boiling Point: 896.1°Cat760mmHg
• Flash Point: 495.7°C
• PSA: 111.87000
• Density: 1.57g/cm³
• LogP: 0.62720
• XLogP3: -3
• Hydrogen Bond Donor Count: 8
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 12
• Exact Mass: 472.15941374
• Heavy Atom Count: 34
• Complexity: 703

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C2C(=C1NCCNCC(=O)O)C(=O)C3=C(C=CC(=C3C2=O)O)O)NCCNCC(=O)O