2-Chloro-1,3-dihydroxy-8-methoxy-6-methylanthracene-9,10-dione

Base Information

• Chemical Name: 2-Chloro-1,3-dihydroxy-8-methoxy-6-methylanthracene-9,10-dione
• CAS No.: 19267-89-1
• Molecular Formula: C16H11ClO5
• Molecular Weight: 318.71
• Metabolomics Workbench ID: 108947
• Nikkaji Number: J156.637G
• Wikidata: Q77495428
• Mol file: 19267-89-1.mol

Synonyms:19267-89-1;2-chloro-1,3-dihydroxy-8-methoxy-6-methylanthracene-9,10-dione;7-Chloro-6,8-dihydroxy-1-meth-oxy-3-methylanthraquinone;CHEBI:213290;1,3-dihydroxy-8-methoxy-2-chloro-6-methylanthraquinone

Chemical Property of 2-Chloro-1,3-dihydroxy-8-methoxy-6-methylanthracene-9,10-dione

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 318.0295011
• Heavy Atom Count: 22
• Complexity: 481

Purity/Quality:

95% ^*data from raw suppliers

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC2=C(C(=C1)OC)C(=O)C3=C(C(=C(C=C3C2=O)O)Cl)O

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