1,4-Dihydroxy-6,7-dimethoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

Base Information

• Chemical Name: 1,4-Dihydroxy-6,7-dimethoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid
• CAS No.: 36441-34-6
• Molecular Formula: C18H14O8
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID00701469
• Nikkaji Number: J17.582J
• Wikidata: Q82633133
• Mol file: 36441-34-6.mol

Synonyms:36441-34-6;Fistulic acid;SCHEMBL23199069;DTXSID00701469;1,4-dihydroxy-6,7-dimethoxy-3-methylanthraquinone-2-carboxylic acid;1,4-Dihydroxy-6,7-dimethoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

Chemical Property of 1,4-Dihydroxy-6,7-dimethoxy-3-methyl-9,10-dioxo-9,10-dihydroanthracene-2-carboxylic acid

Chemical Property:

• PSA: 130.36000
• LogP: 1.89700
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 3
• Exact Mass: 358.06886740
• Heavy Atom Count: 26
• Complexity: 604

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(=C2C(=C1O)C(=O)C3=CC(=C(C=C3C2=O)OC)OC)O)C(=O)O