8-Hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione

Base Information

• Chemical Name: 8-Hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione
• CAS No.: 63702-76-1
• Molecular Formula: C15H14O9
• Molecular Weight: 338.27
• NSC Number: 305533
• DSSTox Substance ID: DTXSID00330758

Synonyms:NSC305533;63702-76-1;DTXSID00330758;NSC-305533

Chemical Property of 8-Hydroxy-8-[3-hydroxy-6-(hydroxymethyl)-4-oxopyran-2-yl]-3,11-dioxatricyclo[5.3.1.01,5]undecane-4,9-dione

Chemical Property:

• Vapor Pressure: 1.03E-28mmHg at 25°C
• XLogP3: -2.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 338.06378202
• Heavy Atom Count: 24
• Complexity: 735

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

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Useful:

• Canonical SMILES: C1C2C(=O)OCC23CC(=O)C(C1O3)(C4=C(C(=O)C=C(O4)CO)O)O

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